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2467 SMILES Strings for Apoptosis regulator Bcl-2

Compound NameSMILES String
BDBM29643 CN1CCc2cccc-3c2[C@@H]1Cc1ccc(O)c(O)c-31
BDBM29644 CN1CCc2cccc-3c2[C@H]1Cc1ccc(O)c(O)c-31
BDBM21400 CN(C)CC[C@H](CSc1ccccc1)Nc1ccc(cc1[N+]([O-])=O)S(=O)(=O)NC(=O)c1ccc(cc1)N1CCC(C)(C)CC1 |r|
BDBM21401 COC1(Cc2ccccc2)CCN(CC1)c1ccc(cc1)C(=O)NS(=O)(=O)c1ccc(N[C@H](CCN(C)C)CSc2ccccc2)c(c1)[N+]([O-])=O |r|
BDBM21402 CN(C)CCC(CSc1ccccc1)Nc1ccc(cc1[N+]([O-])=O)S(=O)(=O)NC(=O)c1ccc(cc1)N1CCC2(C[C-](N=[O+]2)c2ccccc2)CC1 |c:45|
BDBM21403 CN(C)CCC(CSc1ccccc1)Nc1ccc(cc1[N+]([O-])=O)S(=O)(=O)NC(=O)c1ccc(cc1)N1CCC2(C[C-](Cc3ccccc3)N=[O+]2)CC1 |c:53|
BDBM21404 CC1OC2(CCN(CC2)c2ccc(cc2)C(=O)NS(=O)(=O)c2ccc(N[C@H](CCN(C)C)CSc3ccccc3)c(c2)[N+]([O-])=O)N(Cc2ccccc2)C1=O |r|
BDBM21405 [#6]-[#7](-[#6])-[#6]-[#6]-[#6@H](-[#6]-[#16]-c1ccccc1)-[#7]-c1ccc(cc1-[#7+](-[#8-])=O)S(=O)(=O)[#7]-[#6](=O)-c1ccc(cc1)-[#7]-1-[#6]-[#6]\[#6](-[#6]-[#6]-1)=[#6]/c1ccc(F)cc1 |r|
BDBM21406 CN(C)CC[C@H](CSc1ccccc1)Nc1ccc(cc1[N+]([O-])=O)S(=O)(=O)NC(=O)c1ccc(cc1)N1CCN(Cc2ccccc2)CC1 |r|
BDBM21407 CN(C)CC[C@H](CSc1ccccc1)Nc1ccc(cc1[N+]([O-])=O)S(=O)(=O)NC(=O)c1ccc(cc1)N1CCN(CC1)C(=O)c1ccccc1 |r|
BDBM21408 CN(C)CC[C@H](CSc1ccccc1)Nc1ccc(cc1[N+]([O-])=O)S(=O)(=O)NC(=O)c1ccc(cc1)N1CCN(CC1)S(=O)(=O)c1ccc(C)cc1 |r|
BDBM21409 CN(C)CC[C@H](CSc1ccccc1)Nc1ccc(cc1[N+]([O-])=O)S(=O)(=O)NC(=O)c1ccc(cc1)N1CCN(CC1)C(=O)Nc1ccccc1 |r|
BDBM21410 COC1(CC(C)C)CCN(CC1)c1ccc(cc1)C(=O)NS(=O)(=O)c1ccc(N[C@H](CCN(C)C)CSc2ccccc2)c(c1)[N+]([O-])=O |r|
BDBM21411 COC1(CC(C)(C)C)CCN(CC1)c1ccc(cc1)C(=O)NS(=O)(=O)c1ccc(N[C@H](CCN(C)C)CSc2ccccc2)c(c1)[N+]([O-])=O |r|
BDBM21412 CCCCC1(CCN(CC1)c1ccc(cc1)C(=O)NS(=O)(=O)c1ccc(N[C@H](CCN(C)C)CSc2ccccc2)c(c1)[N+]([O-])=O)OC |r|
BDBM21413 COC1(CC2CCCCC2)CCN(CC1)c1ccc(cc1)C(=O)NS(=O)(=O)c1ccc(N[C@H](CCN(C)C)CSc2ccccc2)c(c1)[N+]([O-])=O |r|
BDBM21414 COC1(Cc2ccccc2Cl)CCN(CC1)c1ccc(cc1)C(=O)NS(=O)(=O)c1ccc(N[C@H](CCN(C)C)CSc2ccccc2)c(c1)[N+]([O-])=O |r|
BDBM21415 COC1(Cc2cccc(Cl)c2)CCN(CC1)c1ccc(cc1)C(=O)NS(=O)(=O)c1ccc(N[C@H](CCN(C)C)CSc2ccccc2)c(c1)[N+]([O-])=O |r|
BDBM21416 COC1(Cc2ccc(Cl)cc2)CCN(CC1)c1ccc(cc1)C(=O)NS(=O)(=O)c1ccc(N[C@H](CCN(C)C)CSc2ccccc2)c(c1)[N+]([O-])=O |r|
BDBM21417 COC1(Cc2ccccc2F)CCN(CC1)c1ccc(cc1)C(=O)NS(=O)(=O)c1ccc(N[C@H](CCN(C)C)CSc2ccccc2)c(c1)[N+]([O-])=O |r|
BDBM21418 COC1(Cc2ccccc2C)CCN(CC1)c1ccc(cc1)C(=O)NS(=O)(=O)c1ccc(N[C@H](CCN(C)C)CSc2ccccc2)c(c1)[N+]([O-])=O |r|
BDBM21419 COc1ccccc1CC1(CCN(CC1)c1ccc(cc1)C(=O)NS(=O)(=O)c1ccc(N[C@H](CCN(C)C)CSc2ccccc2)c(c1)[N+]([O-])=O)OC |r|
BDBM21420 COC1(Cc2ccccc2Br)CCN(CC1)c1ccc(cc1)C(=O)NS(=O)(=O)c1ccc(N[C@H](CCN(C)C)CSc2ccccc2)c(c1)[N+]([O-])=O |r|
BDBM21421 COC1(Cc2ccccc2-c2ccccc2)CCN(CC1)c1ccc(cc1)C(=O)NS(=O)(=O)c1ccc(N[C@H](CCN(C)C)CSc2ccccc2)c(c1)[N+]([O-])=O |r|
BDBM21422 COC1(Cc2ccc(cc2)-c2ccccc2)CCN(CC1)c1ccc(cc1)C(=O)NS(=O)(=O)c1ccc(N[C@H](CCN(C)C)CSc2ccccc2)c(c1)[N+]([O-])=O |r|
BDBM21423 [#6]-[#7](-[#6])-[#6]-[#6]-[#6@H](-[#6]-[#16]-c1ccccc1)-[#7]-c1ccc(cc1-[#7+](-[#8-])=O)S(=O)(=O)[#7]-[#6](=O)-c1ccc(cc1)-[#7]-1-[#6]-[#6]\[#6](-[#6]-[#6]-1)=[#6]/c1ccccc1F |r|
BDBM21424 [#6]-[#7](-[#6])-[#6]-[#6]-[#6@H](-[#6]-[#16]-c1ccccc1)-[#7]-c1ccc(cc1-[#7+](-[#8-])=O)S(=O)(=O)[#7]-[#6](=O)-c1ccc(cc1)-[#7]-1-[#6]-[#6]\[#6](-[#6]-[#6]-1)=[#6]/c1ccccc1Cl |r|
BDBM21425 [#6]-[#7](-[#6])-[#6]-[#6]-[#6@H](-[#6]-[#16]-c1ccccc1)-[#7]-c1ccc(cc1-[#7+](-[#8-])=O)S(=O)(=O)[#7]-[#6](=O)-c1ccc(cc1)-[#7]-1-[#6]-[#6]\[#6](-[#6]-[#6]-1)=[#6]/c1ccc(Cl)cc1 |r|
BDBM21426 [#6]-[#7](-[#6])-[#6]-[#6]-[#6@H](-[#6]-[#16]-c1ccccc1)-[#7]-c1ccc(cc1-[#7+](-[#8-])=O)S(=O)(=O)[#7]-[#6](=O)-c1ccc(cc1)-[#7]-1-[#6]-[#6]\[#6](-[#6]-[#6]-1)=[#6]/c1ccccc1C(F)(F)F |r|
BDBM21427 [#6]-[#7](-[#6])-[#6]-[#6]-[#6@H](-[#6]-[#16]-c1ccccc1)-[#7]-c1ccc(cc1-[#7+](-[#8-])=O)S(=O)(=O)[#7]-[#6](=O)-c1ccc(cc1)-[#7]-1-[#6]-[#6]\[#6](-[#6]-[#6]-1)=[#6]/c1ccc(cc1)C(F)(F)F |r|
BDBM21428 [#6]-[#8]-c1ccccc1\[#6]=[#6]-1/[#6]-[#6]-[#7](-[#6]-[#6]-1)-c1ccc(cc1)-[#6](=O)-[#7]S(=O)(=O)c1ccc(-[#7]-[#6@H](-[#6]-[#6]-[#7](-[#6])-[#6])-[#6]-[#16]-c2ccccc2)c(c1)-[#7+](-[#8-])=O |r|
BDBM21429 [#6]-[#7](-[#6])-[#6]-[#6]-[#6@H](-[#6]-[#16]-c1ccccc1)-[#7]-c1ccc(cc1-[#7+](-[#8-])=O)S(=O)(=O)[#7]-[#6](=O)-c1ccc(cc1)-[#7]-1-[#6]-[#6]\[#6](-[#6]-[#6]-1)=[#6]/c1ccccc1C#N |r|
BDBM21430 [#6]-[#7](-[#6])-[#6]-[#6]-[#6@H](-[#6]-[#16]-c1ccccc1)-[#7]-c1ccc(cc1-[#7+](-[#8-])=O)S(=O)(=O)[#7]-[#6](=O)-c1ccc(cc1)-[#7]-1-[#6]-[#6]\[#6](-[#6]-[#6]-1)=[#6]/c1ccccn1 |r|
BDBM21431 [#6]-[#7](-[#6])-[#6]-[#6]-[#6@H](-[#6]-[#16]-c1ccccc1)-[#7]-c1ccc(cc1-[#7+](-[#8-])=O)S(=O)(=O)[#7]-[#6](=O)-c1ccc(cc1)-[#7]-1-[#6]-[#6]\[#6](-[#6]-[#6]-1)=[#6]/c1cccnc1 |r|
BDBM21432 [#6]-[#7](-[#6])-[#6]-[#6]-[#6@H](-[#6]-[#16]-c1ccccc1)-[#7]-c1ccc(cc1-[#7+](-[#8-])=O)S(=O)(=O)[#7]-[#6](=O)-c1ccc(cc1)-[#7]-1-[#6]-[#6]\[#6](-[#6]-[#6]-1)=[#6]/c1ccccc1-c1ccccc1 |r|
BDBM21433 CN(C)CC[C@H](CSc1ccccc1)Nc1ccc(cc1[N+]([O-])=O)S(=O)(=O)NC(=O)c1ccc(cc1)N1CCN(Cc2ccccc2C)CC1 |r|
BDBM21434 CN(C)CC[C@H](CSc1ccccc1)Nc1ccc(cc1[N+]([O-])=O)S(=O)(=O)NC(=O)c1ccc(cc1)N1CCN(Cc2ccccc2C(F)(F)F)CC1 |r|
BDBM21435 COc1ccccc1CN1CCN(CC1)c1ccc(cc1)C(=O)NS(=O)(=O)c1ccc(N[C@H](CCN(C)C)CSc2ccccc2)c(c1)[N+]([O-])=O |r|
BDBM21436 CSc1ccccc1CN1CCN(CC1)c1ccc(cc1)C(=O)NS(=O)(=O)c1ccc(N[C@H](CCN(C)C)CSc2ccccc2)c(c1)[N+]([O-])=O |r|
BDBM21437 CN(C)CC[C@H](CSc1ccccc1)Nc1ccc(cc1[N+]([O-])=O)S(=O)(=O)NC(=O)c1ccc(cc1)N1CCN(Cc2ccccc2S(C)(=O)=O)CC1 |r|
BDBM21438 CN(C)CC[C@H](CSc1ccccc1)Nc1ccc(cc1[N+]([O-])=O)S(=O)(=O)NC(=O)c1ccc(cc1)N1CCN(Cc2ccccc2NC2CCCCC2)CC1 |r|
BDBM21439 CN(C)CC[C@H](CSc1ccccc1)Nc1ccc(cc1[N+]([O-])=O)S(=O)(=O)NC(=O)c1ccc(cc1)N1CCN(Cc2ccccc2N2CCOCC2)CC1 |r|
BDBM21440 CN(C)CC[C@H](CSc1ccccc1)Nc1ccc(cc1[N+]([O-])=O)S(=O)(=O)NC(=O)c1ccc(cc1)N1CCN(Cc2ccccc2C2CCCCC2)CC1 |r|
BDBM21441 CN(C)CC[C@H](CSc1ccccc1)Nc1ccc(cc1[N+]([O-])=O)S(=O)(=O)NC(=O)c1ccc(cc1)N1CCN(Cc2ccccc2-c2ccccc2)CC1 |r|
BDBM21442 CN(C)CC[C@H](CSc1ccccc1)Nc1ccc(cc1[N+]([O-])=O)S(=O)(=O)NC(=O)c1ccc(cc1)N1CCN(Cc2ccccc2-c2cccnc2)CC1 |r|
BDBM21443 COc1cccc(c1)-c1ccccc1CN1CCN(CC1)c1ccc(cc1)C(=O)NS(=O)(=O)c1ccc(N[C@H](CCN(C)C)CSc2ccccc2)c(c1)[N+]([O-])=O |r|
BDBM21444 COc1ccc(cc1)-c1ccccc1CN1CCN(CC1)c1ccc(cc1)C(=O)NS(=O)(=O)c1ccc(N[C@H](CCN(C)C)CSc2ccccc2)c(c1)[N+]([O-])=O |r|
BDBM21445 CN(C)CC[C@H](CSc1ccccc1)Nc1ccc(cc1[N+]([O-])=O)S(=O)(=O)NC(=O)c1ccc(cc1)N1CCN(Cc2ccccc2-c2ccccc2Cl)CC1 |r|
BDBM21446 CN(C)CC[C@H](CSc1ccccc1)Nc1ccc(cc1[N+]([O-])=O)S(=O)(=O)NC(=O)c1ccc(cc1)N1CCN(Cc2ccccc2-c2cccc(Cl)c2)CC1 |r|
BDBM21447 CN(C)CC[C@H](CSc1ccccc1)Nc1ccc(cc1[N+]([O-])=O)S(=O)(=O)NC(=O)c1ccc(cc1)N1CCN(Cc2ccccc2-c2ccc(Cl)cc2)CC1 |r|
BDBM21448 CN(C)CC[C@H](CSc1ccccc1)Nc1ccc(cc1[N+]([O-])=O)S(=O)(=O)NC(=O)c1ccc(cc1)N1CCN(Cc2ccccc2-c2ccc(cc2)-c2ccccc2)CC1 |r|
BDBM21449 CN(C)CC[C@H](CSc1ccccc1)Nc1ccc(cc1[N+]([O-])=O)S(=O)(=O)NC(=O)c1ccc(cc1)N1CCN(Cc2ccccc2-c2ccc(F)cc2)CC1 |r|
BDBM21450 CN(C)CC[C@H](CSc1ccccc1)Nc1ccc(cc1[N+]([O-])=O)S(=O)(=O)NC(=O)c1ccc(cc1)N1CCN(Cc2ccccc2-c2ccc(cc2)C(F)(F)F)CC1 |r|
BDBM21451 CN(C)CC[C@H](CSc1ccccc1)Nc1ccc(cc1[N+]([O-])=O)S(=O)(=O)NC(=O)c1ccc(cc1)N1CCN(Cc2ccccc2-c2ccc(cc2)S(C)(=O)=O)CC1 |r|
BDBM23223 CC(C)c1c(O)c(O)c(C=O)c2c(O)c(c(C)cc12)-c1c(C)cc2c(C(C)C)c(O)c(O)c(C=O)c2c1O |(-4.44,-1.63,;-5.78,-.86,;-7.11,-1.63,;-5.78,.68,;-7.11,1.45,;-8.44,.68,;-7.11,2.99,;-8.44,3.76,;-5.78,3.76,;-5.78,5.3,;-4.44,6.07,;-4.44,2.99,;-3.11,3.76,;-3.11,5.3,;-1.77,2.99,;-1.77,1.45,;-.44,.68,;-3.11,.68,;-4.44,1.45,;-.44,3.76,;-.44,5.3,;-1.77,6.07,;.89,6.07,;2.23,5.3,;3.56,6.07,;3.56,7.61,;4.89,8.38,;2.23,8.38,;4.89,5.3,;6.23,6.07,;4.89,3.76,;6.23,2.99,;3.56,2.99,;3.56,1.45,;4.89,.68,;2.23,3.76,;.89,2.99,;.89,1.45,)|
BDBM25524 COc1ccc2c(c[n+](C)c3c4cc5OCOc5cc4ccc23)c1OC
BDBM31802 CC(C)c1c(O)c(O)cc2c(O)c(c(C)cc12)-c1c(C)cc2c(C(C)C)c(O)c(O)cc2c1O |(-6.3,1.23,;-7.63,1.99,;-8.97,1.22,;-7.63,3.53,;-8.97,4.3,;-10.3,3.53,;-8.97,5.84,;-10.3,6.62,;-7.63,6.61,;-6.3,5.84,;-4.97,6.61,;-4.97,8.15,;-3.63,5.84,;-3.63,4.3,;-2.3,3.53,;-4.97,3.53,;-6.3,4.3,;-2.3,6.62,;-2.3,8.16,;-3.63,8.93,;-.97,8.93,;.37,8.16,;1.7,8.93,;1.7,10.47,;3.04,11.24,;.37,11.24,;3.04,8.16,;4.37,8.93,;3.04,6.62,;4.37,5.85,;1.7,5.85,;.37,6.62,;-.97,5.85,;-.97,4.31,)|
BDBM31803 Cc1cc2c(CCc3ccccc3)c(O)c(O)cc2c(O)c1-c1c(C)cc2c(CCc3ccccc3)c(O)c(O)cc2c1O |(-2.3,3.53,;-3.63,4.3,;-4.97,3.53,;-6.3,4.3,;-7.63,3.53,;-7.63,1.99,;-6.3,1.23,;-6.3,-.31,;-7.63,-1.08,;-7.63,-2.62,;-6.3,-3.39,;-4.97,-2.62,;-4.97,-1.08,;-8.97,4.3,;-10.3,3.53,;-8.97,5.84,;-10.3,6.62,;-7.63,6.61,;-6.3,5.84,;-4.97,6.61,;-4.97,8.15,;-3.63,5.84,;-2.3,6.62,;-2.3,8.16,;-3.63,8.93,;-.97,8.93,;.37,8.16,;1.7,8.93,;1.7,10.47,;3.04,11.24,;3.04,12.78,;1.7,13.55,;1.7,15.09,;3.04,15.86,;4.37,15.09,;4.37,13.55,;3.04,8.16,;4.37,8.93,;3.04,6.62,;4.37,5.85,;1.7,5.85,;.37,6.62,;-.97,5.85,;-.97,4.31,)|
BDBM31804 Cc1cc2c(C(=O)NCC3CCCCC3)c(O)c(O)cc2c(O)c1-c1c(C)cc2c(C(=O)NCC3CCCCC3)c(O)c(O)cc2c1O |(-2.3,3.53,;-3.63,4.3,;-4.97,3.53,;-6.3,4.3,;-7.63,3.53,;-7.63,1.99,;-8.97,1.22,;-6.3,1.23,;-6.3,-.31,;-4.97,-1.08,;-4.97,-2.62,;-3.63,-3.39,;-2.3,-2.62,;-2.3,-1.08,;-3.63,-.31,;-8.97,4.3,;-10.3,3.53,;-8.97,5.84,;-10.3,6.62,;-7.63,6.61,;-6.3,5.84,;-4.97,6.61,;-4.97,8.15,;-3.63,5.84,;-2.3,6.62,;-2.3,8.16,;-3.63,8.93,;-.97,8.93,;.37,8.16,;1.7,8.93,;1.7,10.47,;.37,11.24,;3.04,11.24,;3.04,12.78,;4.37,13.55,;4.37,15.09,;5.7,15.86,;7.04,15.09,;7.04,13.55,;5.7,12.78,;3.04,8.16,;4.37,8.93,;3.04,6.62,;4.37,5.85,;1.7,5.85,;.37,6.62,;-.97,5.85,;-.97,4.31,)|
BDBM31805 Cc1cc2c(C(=O)NCCc3ccccc3)c(O)c(O)cc2c(O)c1-c1c(C)cc2c(C(=O)NCCc3ccccc3)c(O)c(O)cc2c1O |(-2.3,3.53,;-3.63,4.3,;-4.97,3.53,;-6.3,4.3,;-7.63,3.53,;-7.63,1.99,;-8.97,1.22,;-6.3,1.23,;-6.3,-.31,;-4.97,-1.08,;-3.63,-.31,;-3.63,1.23,;-2.3,2,;-.96,1.23,;-.96,-.31,;-2.3,-1.08,;-8.97,4.3,;-10.3,3.53,;-8.97,5.84,;-10.3,6.62,;-7.63,6.61,;-6.3,5.84,;-4.97,6.61,;-4.97,8.15,;-3.63,5.84,;-2.3,6.62,;-2.3,8.16,;-3.63,8.93,;-.97,8.93,;.37,8.16,;1.7,8.93,;1.7,10.47,;.37,11.24,;3.04,11.24,;3.04,12.78,;4.37,13.55,;5.7,12.78,;5.7,11.24,;7.04,10.47,;8.37,11.24,;8.37,12.78,;7.04,13.55,;3.04,8.16,;4.37,8.93,;3.04,6.62,;4.37,5.85,;1.7,5.85,;.37,6.62,;-.97,5.85,;-.97,4.31,)|
BDBM31806 Cc1cc2c(C(=O)NCCc3cccc(Cl)c3)c(O)c(O)cc2c(O)c1-c1c(C)cc2c(C(=O)NCCc3cccc(Cl)c3)c(O)c(O)cc2c1O |(-2.3,3.53,;-3.63,4.3,;-4.97,3.53,;-6.3,4.3,;-7.63,3.53,;-7.63,1.99,;-8.97,1.22,;-6.3,1.23,;-6.3,-.31,;-4.97,-1.08,;-3.63,-.31,;-3.63,1.23,;-2.3,2,;-.96,1.23,;-.96,-.31,;.37,-1.08,;-2.3,-1.08,;-8.97,4.3,;-10.3,3.53,;-8.97,5.84,;-10.3,6.62,;-7.63,6.61,;-6.3,5.84,;-4.97,6.61,;-4.97,8.15,;-3.63,5.84,;-2.3,6.62,;-2.3,8.16,;-3.63,8.93,;-.97,8.93,;.37,8.16,;1.7,8.93,;1.7,10.47,;.37,11.24,;3.04,11.24,;3.04,12.78,;4.37,13.55,;5.7,12.78,;5.7,11.24,;7.04,10.47,;8.37,11.24,;8.37,12.78,;9.7,13.55,;7.04,13.55,;3.04,8.16,;4.37,8.93,;3.04,6.62,;4.37,5.85,;1.7,5.85,;.37,6.62,;-.97,5.85,;-.97,4.31,)|
BDBM31807 CCc1ccc(CCNC(=O)c2c(O)c(O)cc3c(O)c(c(C)cc23)-c2c(C)cc3c(C(=O)NCCc4ccc(CC)cc4)c(O)c(O)cc3c2O)cc1 |(11.04,11.24,;9.7,10.47,;8.37,11.24,;7.04,10.47,;5.7,11.24,;5.7,12.78,;4.37,13.55,;3.04,12.78,;3.04,11.24,;1.7,10.47,;.37,11.24,;1.7,8.93,;3.04,8.16,;4.37,8.93,;3.04,6.62,;4.37,5.85,;1.7,5.85,;.37,6.62,;-.97,5.85,;-.97,4.31,;-2.3,6.62,;-2.3,8.16,;-3.63,8.93,;-.97,8.93,;.37,8.16,;-3.63,5.84,;-3.63,4.3,;-2.3,3.53,;-4.97,3.53,;-6.3,4.3,;-7.63,3.53,;-7.63,1.99,;-8.97,1.22,;-6.3,1.23,;-6.3,-.31,;-4.97,-1.08,;-3.63,-.31,;-3.63,1.23,;-2.3,2,;-.96,1.23,;.37,2,;.37,3.54,;-.96,-.31,;-2.3,-1.08,;-8.97,4.3,;-10.3,3.53,;-8.97,5.84,;-10.3,6.62,;-7.63,6.61,;-6.3,5.84,;-4.97,6.61,;-4.97,8.15,;7.04,13.55,;8.37,12.78,)|
BDBM31808 Cc1cc(C)c(CNC(=O)c2c(O)c(O)cc3c(O)c(c(C)cc23)-c2c(C)cc3c(C(=O)NCc4c(C)cc(C)cc4C)c(O)c(O)cc3c2O)c(C)c1 |(8.37,15.86,;7.04,15.09,;5.7,15.86,;4.37,15.09,;3.04,15.86,;4.37,13.55,;3.04,12.78,;3.04,11.24,;1.7,10.47,;.37,11.24,;1.7,8.93,;3.04,8.16,;4.37,8.93,;3.04,6.62,;4.37,5.85,;1.7,5.85,;.37,6.62,;-.97,5.85,;-.97,4.31,;-2.3,6.62,;-2.3,8.16,;-3.63,8.93,;-.97,8.93,;.37,8.16,;-3.63,5.84,;-3.63,4.3,;-2.3,3.53,;-4.97,3.53,;-6.3,4.3,;-7.63,3.53,;-7.63,1.99,;-8.97,1.22,;-6.3,1.23,;-6.3,-.31,;-4.97,-1.08,;-3.63,-.31,;-3.63,1.23,;-2.3,-1.08,;-2.3,-2.62,;-.96,-3.39,;-3.63,-3.39,;-4.97,-2.62,;-6.3,-3.39,;-8.97,4.3,;-10.3,3.53,;-8.97,5.84,;-10.3,6.62,;-7.63,6.61,;-6.3,5.84,;-4.97,6.61,;-4.97,8.15,;5.7,12.78,;5.7,11.24,;7.04,13.55,)|
BDBM31809 CC(NC(=O)c1c(O)c(O)cc2c(O)c(c(C)cc12)-c1c(C)cc2c(C(=O)NC(C)c3ccc(Cl)cc3)c(O)c(O)cc2c1O)c1ccc(Cl)cc1 |(-7.63,-1.08,;-6.3,-.31,;-6.3,1.23,;-7.63,1.99,;-8.97,1.22,;-7.63,3.53,;-8.97,4.3,;-10.3,3.53,;-8.97,5.84,;-10.3,6.62,;-7.63,6.61,;-6.3,5.84,;-4.97,6.61,;-4.97,8.15,;-3.63,5.84,;-3.63,4.3,;-2.3,3.53,;-4.97,3.53,;-6.3,4.3,;-2.3,6.62,;-2.3,8.16,;-3.63,8.93,;-.97,8.93,;.37,8.16,;1.7,8.93,;1.7,10.47,;.37,11.24,;3.04,11.24,;3.04,12.78,;1.7,13.55,;4.37,13.55,;4.37,15.09,;5.7,15.86,;7.04,15.09,;8.37,15.86,;7.04,13.55,;5.7,12.78,;3.04,8.16,;4.37,8.93,;3.04,6.62,;4.37,5.85,;1.7,5.85,;.37,6.62,;-.97,5.85,;-.97,4.31,;-4.97,-1.08,;-4.97,-2.62,;-3.63,-3.39,;-2.3,-2.62,;-.96,-3.39,;-2.3,-1.08,;-3.63,-.31,)|
BDBM31810 CC(CNC(=O)c1c(O)c(O)cc2c(O)c(c(C)cc12)-c1c(C)cc2c(C(=O)NCC(C)c3ccccc3)c(O)c(O)cc2c1O)c1ccccc1 |(5.7,12.78,;4.37,13.55,;3.04,12.78,;3.04,11.24,;1.7,10.47,;.37,11.24,;1.7,8.93,;3.04,8.16,;4.37,8.93,;3.04,6.62,;4.37,5.85,;1.7,5.85,;.37,6.62,;-.97,5.85,;-.97,4.31,;-2.3,6.62,;-2.3,8.16,;-3.63,8.93,;-.97,8.93,;.37,8.16,;-3.63,5.84,;-3.63,4.3,;-2.3,3.53,;-4.97,3.53,;-6.3,4.3,;-7.63,3.53,;-7.63,1.99,;-8.97,1.22,;-6.3,1.23,;-6.3,-.31,;-4.97,-1.08,;-3.63,-.31,;-4.97,-2.62,;-6.3,-3.39,;-6.3,-4.93,;-4.97,-5.71,;-3.63,-4.93,;-3.63,-3.39,;-8.97,4.3,;-10.3,3.53,;-8.97,5.84,;-10.3,6.62,;-7.63,6.61,;-6.3,5.84,;-4.97,6.61,;-4.97,8.15,;4.37,15.09,;3.04,15.86,;3.04,17.4,;4.37,18.17,;5.7,17.4,;5.7,15.86,)|
BDBM31811 Cc1cc2c(C(=O)NC3Cc4ccccc4C3)c(O)c(O)cc2c(O)c1-c1c(C)cc2c(C(=O)NC3Cc4ccccc4C3)c(O)c(O)cc2c1O |(-2.3,3.53,;-3.63,4.3,;-4.97,3.53,;-6.3,4.3,;-7.63,3.53,;-7.63,1.99,;-8.97,1.22,;-6.3,1.23,;-6.3,-.31,;-7.55,-1.22,;-7.07,-2.68,;-7.84,-4.02,;-7.07,-5.35,;-5.53,-5.35,;-4.76,-4.02,;-5.53,-2.68,;-5.05,-1.22,;-8.97,4.3,;-10.3,3.53,;-8.97,5.84,;-10.3,6.62,;-7.63,6.61,;-6.3,5.84,;-4.97,6.61,;-4.97,8.15,;-3.63,5.84,;-2.3,6.62,;-2.3,8.16,;-3.63,8.93,;-.97,8.93,;.37,8.16,;1.7,8.93,;1.7,10.47,;.37,11.24,;3.04,11.24,;3.04,12.78,;1.83,13.73,;2.36,15.17,;1.65,16.54,;2.47,17.84,;4.01,17.78,;4.73,16.41,;3.9,15.11,;4.32,13.63,;3.04,8.16,;4.37,8.93,;3.04,6.62,;4.37,5.85,;1.7,5.85,;.37,6.62,;-.97,5.85,;-.97,4.31,)|
BDBM31713 O=C(NC1CC1)Nc1ccc2nc(-c3ccco3)c(nc2c1)-c1ccco1
BDBM31075 O=C(Nc1ccc(cc1)N1CCOCC1)Nc1ccc2nc(-c3ccco3)c(nc2c1)-c1ccco1
BDBM33196 COc1ccccc1NC1=C(NC(C)=O)C(=O)c2ccccc2C1=O |c:10|
BDBM33075 FC(F)(F)c1cccc(NC(=O)c2ccc3nc(-c4ccco4)c(nc3c2)-c2ccco2)c1
BDBM33076 COc1ccc2nc(-c3ccco3)c(nc2c1)-c1ccco1
BDBM33078 CC(C)(C)NC(=O)COc1ccc(CNc2ccc3[nH]c(=O)[nH]c3c2)cc1
BDBM33081 CN(CCO)c1cc(Sc2nc3ccccc3s2)c2nonc2c1[N+]([O-])=O
BDBM33083 CCOC(=O)C1=C(Cc2ccc(OC)cc2)C(=O)c2ccccc2C1=O |c:5|
BDBM33084 CN(C)c1ccc(cc1)\N=C1/C(C)=C(C#N)C(=O)N(CCO)C1=O |t:13|
BDBM33118 CCOC(=O)CSC1=NC(=O)\C(S1)=C\c1ccc(OC)cc1 |t:7|
BDBM33123 Cc1cccc(OCC(=O)NCC(=O)NN=Cc2cc(Br)ccc2OCc2ccccc2)c1 |w:15.14|
BDBM33127 Cc1ccc(NC2=C(NC(=O)c3ccccc3)C(=O)c3ccccc3C2=O)cc1Cl |c:6|
BDBM33131 Clc1ccc2c(ccnc2c1)N=NCc1ccccc1Br |w:11.12|
BDBM33134 C1CN(CCO1)c1nc(-c2ccccc2)n([s+]1)-c1ccccc1
BDBM33199 Cc1ccc(o1)-c1nc2n(Cc3ccccc3)c(=O)[nH]c(=O)c2n1C
BDBM33155 O=C(Nc1ccc2nc(-c3ccco3)c(nc2c1)-c1ccco1)N1CCN(CC1)c1ccccn1
BDBM33200 CCN(CC)C(=O)COC(=O)c1cc(nc2ccccc12)-c1ccco1
BDBM33139 Cc1ccc(C)c(\C=C\C(=O)c2ccccc(=O)c2O)c1
BDBM33141 COc1ccc(\C=C\C(=O)c2cc(Br)ccc(=O)c2O)cc1
BDBM33142 Clc1ccc(NC2=C(NC(=O)c3ccccc3)C(=O)c3ccccc3C2=O)cc1 |c:6|
BDBM33157 O=C(c1ccccc1)c1ccc2nc(-c3ccco3)c(nc2c1)-c1ccco1
BDBM33159 O=C(NC1=C(NC2CCS(=O)(=O)C2)C(=O)c2ccccc2C1=O)c1ccccc1 |c:3|
BDBM33162 Oc1c([O-])ccc(C[NH+]=Nc2ccc(cc2S(=O)(=O)N2CCOCC2)[N+]([O-])=O)c1O |w:9.9|
BDBM33038 COc1cc(ccc1OC(C)=O)C1Nc2cccc3cccc(N1)c23
BDBM33040 COC(=O)CSc1ncnc2c1sc1nc(-c3ccco3)c3COC(C)(C)Cc3c21
BDBM33087 O=C(NCc1ccccc1)c1ccc2nc(-c3ccco3)c(nc2c1)-c1ccco1
BDBM33047 C\C(=C/c1ccco1)C1Nc2cccc3cccc(N1)c23
BDBM33048 CN(C)c1ccc(cc1)\N=C1/C(C)=C(C#N)C(=O)N(CCCO)C1=O |t:13|
BDBM33089 Cc1cc(N)ccc1N1CCCC1
BDBM33093 COC(=O)c1c(C(=O)OC)c2cccc3cc(-c4ccccc4)c4ccc1c4n23
BDBM33095 COc1ccc2c(C)nn(C)c3cccc1c23
BDBM33164 CCOc1ccccc1CNc1ccc(O)cc1
BDBM33050 O=C(NCc1ccccn1)c1ccc2nc(-c3ccco3)c(nc2c1)-c1ccco1
BDBM33096 OCCCNc1cc(Sc2nc3ccccc3s2)c2nonc2c1[N+]([O-])=O
BDBM33097 CC(=O)OCCCNc1cc(Sc2nc3ccccc3s2)c2nonc2c1[N+]([O-])=O
BDBM33055 O=C(Nc1ccccc1)c1ccc2nc(-c3ccco3)c(nc2c1)-c1ccco1
BDBM33057 Cc1cc2nn(nc2cc1N)-c1cccc2ccccc12
BDBM33178 Clc1nss\c1=N/c1ccc(Br)cc1
BDBM33065 CCOC(=O)C1CCN(CC1)C(=O)Nc1ccc2nc(-c3ccco3)c(nc2c1)-c1ccco1
BDBM33066 CN(C)c1ncc(s1)C1=C(Cl)C(=O)C(N2CCCC2)=C(Cl)C1=O |c:9,t:20|
BDBM33067 CNc1ccc(Br)cc(C(=O)\C=C\c2cccc(OC)c2)c1=O
BDBM33069 CNc1ccc(Br)cc(C(=O)\C=C\c2cc(OC)ccc2OC)c1=O
BDBM33186 [#6]-[#7](-[#6])-c1ccc(\[#6]=[#6]-2/[#6](=O)-[#7]-[#6](=O)-[#7]-[#6]-2=O)cc1-[#7+](-[#8-])=O
BDBM33192 CC(=NNC(=O)c1cc(O)c(O)c(O)c1)c1ccc(cc1)[N+]([O-])=O |w:2.2|
BDBM32278 N(c1ccccc1)c1cccc(Nc2ccccc2)n1
BDBM32313 Oc1c(ccccc1=O)C(=O)\C=C\c1ccccc1Cl
BDBM32330 Cc1csc(n1)C(C#N)=C1C(=O)Nc2ccc(F)cc12 |w:9.20|
BDBM34138 Oc1cc(Cc2ccccc2)c(Cc2ccccc2)cc1O
BDBM33102 CCN(C1C(=O)C(=O)c2ccccc2C1=O)C(=O)CC
BDBM33106 c1ccc(cc1)-c1nc2cccc3cccc([nH]1)c23
BDBM33109 Nc1ccc(cc1)-c1nc2cccc3cccc([nH]1)c23
BDBM33171 Fc1ccc(cc1)-c1nc2cccc3cccc([nH]1)c23
BDBM33172 c1coc(c1)-c1nc2cccc3cccc([nH]1)c23
BDBM33173 O=C1N(C(=S)NC1=Cc1ccco1)c1ccccc1 |w:7.8|
BDBM33054 N#Cc1cc(nn1-c1ccccc1)-c1ccccc1
BDBM32273 Cc1cc2-c3ccc(C)n3CCn2c1
BDBM32274 CN1CCN(CC1)C1=C(Cl)C(=O)C(c2cnc(s2)N2CCCCC2)=C(Cl)C1=O |c:8,t:26|
BDBM32275 Clc1nc(NCc2cccnc2)nc(n1)N1CCOCC1
BDBM32279 CCOC(=O)c1ccc(Nc2nc(nc3ccccc23)C(=O)OCC)cc1
BDBM32280 CC(=O)c1ccc(NC(=O)c2ccc3nc(-c4ccco4)c(nc3c2)-c2ccco2)cc1
BDBM32281 COc1ccc(cc1OC)C1=Nn2c(SC1)nnc2-c1ccco1 |t:11|
BDBM32283 COCCCn1c(N)c(C(=O)Nc2sc3CCCCc3c2C(=O)OC)c2nc3ccccc3nc12
BDBM32285 COc1cc(CN=Nc2nn3cnnc3c3ccccc23)ccc1O |w:7.7|
BDBM32286 CCOC(=O)c1nc(Nc2ccc(cc2)C(=O)OC)c2ccccc2n1
BDBM32287 Clc1ccccc1-c1ccc(\C=C2\SC(=S)N(CC3CCCO3)C2=O)o1
BDBM32288 CN(N=Cc1ccncc1)C1=NS(=O)(=O)c2ccccc12 |w:2.1,t:11|
BDBM32289 O=[#6]-1\[#6](=[#6]\c2cn(-[#6]C#C)c3ccccc23)-[#6](=O)-c2ccccc-12
BDBM32295 CCN1C(=S)S\C(=C/C=C2\C=CN(CC)c3ccccc23)C1=O |c:10|
BDBM32296 Cc1ccc(cc1)C(=O)\C=C\c1ccc(o1)-c1ccc(C)cc1
BDBM32298 Cc1ccc(cc1)-c1ccc(\C=C\C(=O)c2ccccc2)o1
BDBM32299 CC\C(=C/c1sc2ccc(OC)cc2[n+]1CCO)\C=C1/Sc2ccc(OC)cc2N1CCO
BDBM32300 Cc1nc2ncccn2c1-c1csc(Nc2ccccc2)n1
BDBM32303 Cc1cc(C)nc(SCc2cc(=O)c(OC(=O)c3ccc(Cl)c(c3)[N+]([O-])=O)co2)n1
BDBM32308 O=C(\C=C/c1ccc(o1)-c1ccccc1)c1ccccc1
BDBM32309 COc1ccc(c(OC)c1)-n1c(=O)c2ccccc2c2ccccc2c1=O |(10.09,6.35,;10.96,5.08,;10.29,3.69,;8.76,3.58,;8.09,2.19,;8.96,.92,;10.49,1.03,;11.36,-.24,;12.9,-.12,;11.16,2.42,;8.29,-.47,;9.25,-1.67,;10.75,-1.33,;8.91,-3.17,;10.25,-4.06,;10.14,-5.66,;8.69,-6.35,;7.38,-5.44,;7.52,-3.84,;6.13,-3.17,;4.97,-4.28,;3.44,-3.82,;3.08,-2.26,;4.26,-1.18,;5.79,-1.67,;6.75,-.47,;6.08,.92,)|
BDBM32310 Nc1c(sc2nc3\C(CCc3c(-c3ccco3)c12)=C\c1ccco1)C(=O)NCC1CCCO1
BDBM32311 Nc1c(sc2nc3\C(CCc3c(-c3ccco3)c12)=C/c1ccco1)C(=O)NC1CC1
BDBM32312 COc1cc(\C=C2/CC\C(=C/c3cc(OC)c(O)c(OC)c3)C2=O)cc(OC)c1O
BDBM32050 O=C1c2ccccc2-c2onc3ccc(NCCCn4ccnc4)c1c23
BDBM32314 OCCN1CCN(CCCc2c3CCCc3cc3CCCc23)CC1
BDBM32316 CCOC(=O)c1c2-c3ccccc3C(=O)c3c(Cl)ccc([nH]c1=O)c23
BDBM32317 COc1cccc2c(SCC(=O)NN=Cc3ccc(O)cc3O)cc(C)nc12 |w:13.12|
BDBM32318 Cc1nc2ncccn2c1-c1csc(Nc2ccc(O)cc2)n1
BDBM32319 Cc1ccc(cc1)-c1ccc(\C=C2/SC(=NC2=O)N2CCOCC2)o1 |c:15|
BDBM32320 O=C1c2ccccc2-c2onc3ccc(N4CCCC4)c1c23
BDBM32328 COc1cc2nc(=S)[nH]c(NCCc3ccc(cc3)S(N)(=O)=O)c2cc1OC
BDBM32329 CCN1\C(Sc2ccccc12)=C\C(\C)=C\c1sc2ccccc2[n+]1CC
BDBM60606 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(NCN4CCN(Cc5nccs5)CC4)c(c3)[N+]([O-])=O)c(Oc3ccc4[nH]ccc4c3)c2)=C(C1)c1ccc(Cl)cc1 |c:64|
BDBM32262 CSc1nnc2c3cc(C)ccc3n(Cc3ccccc3)c2n1
BDBM32264 C1CCCN(CC1)c1nc(nc2ccccc12)-c1ccccn1
BDBM32266 COc1ccc(CCNC(=O)c2ccc3nc(-c4ccco4)c(nc3c2)-c2ccco2)cc1OC
BDBM32035 O=C1c2ccccc2-c2onc3ccc(NCc4ccco4)c1c23
BDBM40705 Cc1cc(-c2csc(N)n2)c(C)n1C
BDBM43199 Oc1ccc(Br)cc1-c1nnc(SCC(=O)Nc2ccc3OCOc3c2)n1CC=C
BDBM43200 COc1ccc(CC(=O)Nc2ccc(-c3nc4cc(C)ccc4o3)c(O)c2)cc1OC
BDBM43201 CN(C)[C@H]1C2CC3C(C(=O)c4c(O)cccc4[C@@]3(C)O)C(=O)[C@]2(O)C(=O)C(C(=O)NCN2CCCC2)C1=O
BDBM43202 CCc1ccc(\C=C\C(=O)c2cc(Br)ccc(=O)c2O)cc1
BDBM43203 Cc1ccc(C=NNC(=O)CSc2nnc(-c3ccc(Cl)cc3)n2-c2ccccc2)o1 |w:6.6|
BDBM46302 O=C1NC(=O)C2(Cc3c(nc4ccccn4c3=O)N3CCCCCC23)C(=O)N1Cc1ccccc1
BDBM53290 OC(=O)CSc1cc(NS(=O)(=O)c2ccc(Br)cc2)c2ccccc2c1O
BDBM109232 OC(=O)c1cccc(n1)-c1ccc2CCCC(=NNc3nc4ccccc4s3)c2c1 |w:17.18|
BDBM109233 OC(=O)c1csc(n1)-c1ccc2CCCC(=NNc3nc4ccccc4s3)c2c1 |w:16.17|
BDBM109236 NCc1ccc(OCCCc2sc(nc2C(O)=O)-c2ccc3CCCC(=NNc4nc5ccccc5s4)c3c2)cc1 |w:26.27|
BDBM144820 CN(C)Cc1cccc(Oc2cc(ccc2C(=O)NS(=O)(=O)c2ccc(NCC3CCOCC3)c(c2)[N+]([O-])=O)N2CCN(Cc3ccccc3-c3ccc(Cl)cc3)CC2)c1
BDBM50024671 CCSCCCCC(c1ccc(O)cc1)C(C)(CC)c1ccc(O)cc1
BDBM50060993 OC(=O)c1ccc(cc1)-c1ccc(F)cc1
BDBM50107130 CC(C)C(N1C(=S)S\C(=C/c2ccc(Br)cc2)C1=O)C(O)=O
BDBM50107131 CCOC(=O)C(C#N)C1C(C(N)Oc2ccc(Br)cc12)C(=O)OCC
BDBM50107132 CCCC[C@@H]1[C@@H](OC(=O)CC(C)C)[C@H](C)OC(=O)[C@@H](NC(=O)c2cccc(NC=O)c2O)[C@@H](C)OC1=O
BDBM50107133 O=c1c2ccc(c3cccc(c4nc5ccccc5n14)c23)S(=O)(=O)c1ccc2c3c1cccc3c1nc3ccccc3n1c2=O
BDBM50107129 COc1ccc2NC3C=CC(C=C3C(=O)c2c1)[N+]#N |c:8,11|
BDBM50107123 Nc1nc(nc2[n+]([O-])c3ccccc3[n+]([O-])c12)-c1ccccc1
BDBM50107124 COc1ccc2N([O-])[N+](=O)c3ccc(OC)cc3CCc2c1
BDBM50107125 Brc1cccc[n+]1-c1ccc2cc(ccc2c1)-[n+]1ccccc1Br
BDBM50107126 NC(=N)c1ccc(cc1)N=Nc1c(O)ccc2c3ccccc3[nH]c12 |w:9.9|
BDBM50107127 Brc1ccc2c3ccc4c5ccc6c7ccc(Br)cc7c(=O)c7ccc(c8ccc(c3c48)c(=O)c2c1)c5c67
BDBM50107128 Cc1cc(Cl)cc(C(=O)Nc2cc(ccc2Cl)S(=O)(=O)c2ccc(Cl)cc2)c1O
BDBM50172735 CSCC[C@H](NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](CCCNC(N)=N)NC(=O)CNC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](N)CC(N)=O)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](CCC(O)=O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCC(O)=O)C(=O)NCC(=O)N[C@@H](C)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCCCN)C(=O)NCC(=O)N[C@@H](CC(C)C)C(O)=O
BDBM50172741 CSCC[C@H](NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](CCCNC(N)=N)NC(=O)CNC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](N)CC(N)=O)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](CCC(O)=O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCC(O)=O)C(=O)NCC(O)=O
BDBM50172729 CC[C@H](C)[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](N)CC(N)=O)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](C(C)C)C(=O)NCC(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCCCN)C(=O)NCC(=O)N[C@@H](CC(C)C)C(O)=O
BDBM50172730 CSCC[C@H](NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](CCCNC(N)=N)NC(=O)CNC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](N)CC(N)=O)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](CCC(O)=O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCC(O)=O)C(=O)NCC(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCCN)C(=O)NCC(=O)N[C@@H](CC(C)C)C(O)=O
BDBM50172736 CSCC[C@H](NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](CCCNC(N)=N)NC(=O)CNC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](C)CC(N)=O)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](CCC(O)=O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCC(O)=O)C(=O)NCC(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCCCN)C(=O)NCC(=O)N[C@@H](CC(C)C)C(O)=O
BDBM50172731 CSCC[C@H](NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](CCCNC(N)=N)NC(=O)CNC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](N)CC(N)=O)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](CCC(O)=O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCC(O)=O)C(=O)NCC(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCCCN)C(=O)NCC(=O)N[C@@H](CC(C)C)C(O)=O
BDBM50172737 CC[C@H](C)[C@H](NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCNC(N)=N)NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](CCC(N)=O)NC(=O)CNC(=O)[C@H](CCSC)NC(=O)[C@@H](NC(=O)[C@H](CO)NC(=O)[C@H](CO)NC(=O)[C@@H]1CCCN1)[C@@H](C)O)C(C)C)[C@@H](C)CC)C(=O)NCC(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H]([C@@H](C)CC)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCC(O)=O)C(O)=O
BDBM50172742 CC[C@H](C)[C@H](NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CS)NC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](CO)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCCN)NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](N)CC(N)=O)C(=O)NCC(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](CCC(O)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](CO)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCCCN)C(=O)NCC(=O)N[C@@H](CC(C)C)C(O)=O
BDBM50172732 CC[C@H](C)[C@H](NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CS)NC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](CO)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](N)CCCCN)C(=O)NCC(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](CCC(O)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](CO)C(O)=O
BDBM50172738 CC[C@H](C)[C@H](NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCNC(N)=N)NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](CCC(N)=O)NC(=O)CN)C(C)C)[C@@H](C)CC)C(=O)NCC(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H]([C@@H](C)CC)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCCNC(N)=N)C(O)=O
BDBM50172743 CC[C@H](C)[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CC(O)=O)NC(=O)[C@H](CCC(O)=O)NC(=O)[C@@H](N)CCC(N)=O)[C@@H](C)CC)[C@@H](C)CC)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](C(C)C)C(=O)NCC(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CO)C(=O)N[C@@H]([C@@H](C)CC)C(=O)N1CCC[C@H]1C(=O)N1CCC[C@H]1C(=O)NCC(O)=O
BDBM50172733 CSCC[C@H](NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](CCCNC(N)=N)NC(=O)CNC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H](N)CCC(N)=O)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](CCC(O)=O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCC(O)=O)C(=O)NCC(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCCCN)C(=O)NCC(=O)N[C@@H](CC(C)C)C(O)=O
BDBM50172744 CC[C@H](C)[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](N)CCCNC(N)=N)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](C(C)C)C(=O)NCC(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](CCCNC(N)=N)C(O)=O
BDBM50172739 CC[C@H](C)[C@H](NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CS)NC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](CO)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](NC(=O)[C@H](CO)NC(=O)[C@H](C)NC(=O)[C@H](CC(O)=O)NC(=O)[C@@H](N)CCC(N)=O)[C@@H](C)O)C(=O)NCC(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](CCC(O)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CCC(O)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(N)=O)C(O)=O
BDBM50172734 CC[C@H](C)[C@H](NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCNC(N)=N)NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](CCC(N)=O)NC(=O)CNC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](N)CC(N)=O)C(C)C)[C@@H](C)CC)C(=O)NCC(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H]([C@@H](C)CC)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCCCN)C(=O)NCC(=O)N[C@@H](CC(C)C)C(O)=O
BDBM50172740 CSCC[C@H](NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](CCCNC(N)=N)NC(=O)CNC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H](N)CC(N)=O)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](CCC(O)=O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCC(O)=O)C(=O)NCC(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCCCN)C(=O)NCC(=O)N[C@@H](CC(C)C)C(O)=O
BDBM161572 CC(Nc1ncnc(N)c1C#N)c1cc(Cl)c2ccnnc2c1-c1cccc(F)c1
BDBM161479 CN1CCN(C[C@@H]2Cc3ccccc3CN2C(=O)c2ccc(Cl)cc2-c2cc(cn2C2CC2)C(=O)N(c2ccc(O)cc2)c2ccc3n(C)ccc3c2)CC1
BDBM161490 Cc1c(cc(-c2cc3OCCOc3cc2C(=O)N2Cc3ccccc3C[C@H]2CN2CCOCC2)n1C)C(=O)N(c1cnn(C)c1)c1ccc(O)cc1
BDBM161491 Cc1c(cc(-c2cc3OCCOc3cc2C(=O)N2Cc3ccccc3C[C@H]2CN2CCOCC2)n1C)C(=O)N(c1ccccc1)c1ccc(O)cc1
BDBM161489 COc1ccc(C(=O)N2Cc3ccccc3C[C@H]2C)c(c1)-c1cc(C(=O)N(c2ccncc2)c2ccc(O)cc2)c(C)n1C
BDBM161492 C[C@@H]1Cc2ccccc2CN1C(=O)c1cc2OCOc2cc1-c1cc(C(=O)N(c2cnn(C)c2)c2ccc(O)cc2)c(C)n1CCO
BDBM161494 Cc1c(cc(-c2cc(Cl)ccc2C(=O)N2Cc3ccccc3C[C@H]2CN2CCOCC2)n1C)C(=O)N(c1cnn(C)c1)c1ccc(O)cc1
BDBM161535 Cc1c(cc(-c2cc(F)ccc2C(=O)N2Cc3ccccc3C[C@H]2CN2CCOCC2)n1C)C(=O)N(c1cnn(C)c1)c1ccc(O)cc1
BDBM161587 Cc1c(cc(-c2cc(F)ccc2C(=O)N2Cc3ccccc3C[C@H]2CN2CCOCC2)n1C)C(=O)N(c1cnn(c1)[C@H]1CCOC1)c1ccc(O)cc1
BDBM161571 Cc1c(cc(C#N)n1C)N(C(=O)c1cc(-c2cc(Cl)ccc2C(=O)N2Cc3ccccc3C[C@H]2CN2CCOCC2)n(C)c1C)c1ccc(O)cc1
BDBM161473 C[C@@H]1Cc2ccccc2CN1C(=O)c1ccc(Cl)cc1-c1cc(C(=O)N(c2cnn(C)c2)c2ccc(O)cc2)c(C)n1C
BDBM161482 Cc1c(cc(-c2cc(F)ccc2C(=O)N2Cc3ccccc3C[C@H]2CN2CCOCC2)n1C)C(=O)N(c1ccccc1)c1ccc(O)cc1
BDBM161483 Cc1c(cc(-c2cc(F)ccc2C(=O)N2Cc3ccccc3C[C@H]2CN2CCOCC2)n1CCCO)C(=O)N(c1ccccc1)c1ccc(O)cc1
BDBM161481 CN1CCN(C[C@@H]2Cc3ccccc3CN2C(=O)c2cc3OCOc3cc2-c2cc(cn2C)C(=O)N(c2ccc(O)cc2)c2ccc3n(C)ccc3c2)CC1
BDBM161484 Cc1c(cc(-c2cc(F)ccc2C(=O)N2Cc3ccccc3C[C@H]2CN2CCOCC2)n1C)C(=O)N(c1ccc(O)cc1)c1ccc2n(C)ncc2c1
BDBM161495 CNCCn1c(C)c(cc1-c1cc2OCOc2cc1C(=O)N1Cc2ccccc2C[C@H]1C)C(=O)N(c1cnn(C)c1)c1ccc(O)cc1
BDBM161493 COc1ccc(C(=O)N2Cc3ccccc3C[C@H]2CN2CCOCC2)c(c1)-c1cc(C(=O)N(c2cnn(C)c2)c2ccc(O)cc2)c(C)n1C
BDBM161496 C[C@@H]1Cc2ccccc2CN1C(=O)c1cc2OCOc2cc1-c1cc(C(=O)N(c2cnn(C)c2)c2ccc(O)cc2)c(C)n1CCN(C)C
BDBM161554 Cc1c(cc(-c2cc(Cl)ccc2C(=O)N2Cc3ccccc3C[C@H]2CN2CCOCC2)n1C)C(=O)N(c1cc(C#N)n(C)c1)c1ccc(O)cc1
BDBM161477 CN1CCN(C[C@@H]2Cc3ccccc3CN2C(=O)c2ccc(Cl)cc2-c2cc(cn2C)C(=O)N(c2ccc(O)cc2)c2ccc3n(C)ccc3c2)CC1
BDBM161475 CN1CCN(C[C@@H]2Cc3ccccc3CN2C(=O)c2ccc(Cl)cc2-c2cc(cn2C)C(=O)N(c2ccc(O)cc2)c2ccc3[nH]ccc3c2)CC1
BDBM161478 CCn1cc(cc1-c1cc(Cl)ccc1C(=O)N1Cc2ccccc2C[C@H]1CN1CCN(C)CC1)C(=O)N(c1ccc(O)cc1)c1ccc2n(C)ccc2c1
BDBM161486 Cc1c(cc(-c2cc3OCOc3cc2C(=O)N2Cc3ccccc3C[C@H]2CN2CCOCC2)n1C)C(=O)N(c1ccc(O)cc1)c1cccc(F)c1
BDBM161487 Cc1c(cc(-c2cc(Cl)ccc2C(=O)N2Cc3ccccc3C[C@H]2CN2CCOCC2)n1C)C(=O)N(c1ccccc1)c1ccc(O)cc1
BDBM161485 Cc1c(cc(-c2cc3OCOc3cc2C(=O)N2Cc3ccccc3C[C@H]2CN2CCOCC2)n1C)C(=O)N(c1ccc(O)cc1)c1ccc(C)c(F)c1
BDBM161488 Cc1c(cc(-c2cc3OCOc3cc2C(=O)N2Cc3ccccc3C[C@H]2CCN2CCOCC2)n1CCO)C(=O)N(c1ccccc1)c1ccc(O)cc1
BDBM161497 C[C@@H]1Cc2ccccc2CN1C(=O)c1ccc(Cl)cc1-c1cc(C(=O)N(c2ccncc2)c2ccc(O)cc2)c(C)n1C
BDBM50181867 CN(C)CC[C@@H](CSc1ccccc1)Nc1ccc(cc1[N+]([O-])=O)S(=O)(=O)NC(=O)c1ccc(cc1)N1CCC(C)(C)CC1
BDBM50181868 COc1cc(CCCO)ccc1-c1ccc(cc1)C(=O)NS(=O)(=O)c1ccc(NCCSc2ccccc2)c(c1)[N+]([O-])=O
BDBM50181869 COc1cc(CCCN2CCOCC2)ccc1-c1ccc(cc1)C(=O)NS(=O)(=O)c1ccc(N[C@H](CCCCN(C)C)CSc2ccccc2)c(c1)[N+]([O-])=O
BDBM50181870 COc1cc(CCCN(C)C)ccc1-c1ccc(cc1)C(=O)NS(=O)(=O)c1ccc(NCCSc2ccccc2)c(c1)[N+]([O-])=O
BDBM50181871 CN(C)C(=O)N1CCN(CC1)c1ccc(cc1)C(=O)NS(=O)(=O)c1ccc(NCCSc2ccccc2)c(c1)[N+]([O-])=O
BDBM50181872 COc1cc(CCCN2CCOCC2)ccc1-c1ccc(cc1)C(=O)NS(=O)(=O)c1ccc(N[C@H](CCCN(C)C)CSc2ccccc2)c(c1)[N+]([O-])=O
BDBM50181873 CC1(C)CCN(CC1)c1ccc(cc1)C(=O)NS(=O)(=O)c1ccc(NCCSc2ccccc2)c(c1)[N+]([O-])=O
BDBM50181874 COc1cc(CCC(=O)N2CCOCC2)ccc1-c1ccc(cc1)C(=O)NS(=O)(=O)c1ccc(NCCSc2ccccc2)c(c1)[N+]([O-])=O
BDBM50181875 COc1cc(CCCN2CCOCC2)ccc1-c1ccc(cc1)C(=O)NS(=O)(=O)c1ccc(N[C@H](CCN(C)C)CSc2ccccc2)c(c1)[N+]([O-])=O
BDBM50181876 [O-][N+](=O)c1cc(ccc1NCCSc1ccccc1)S(=O)(=O)NC(=O)c1ccc(cc1)-c1ccc(F)cc1
BDBM50181877 CN(C)CCCC[C@H](CSc1ccccc1)Nc1ccc(cc1[N+]([O-])=O)S(=O)(=O)NC(=O)c1ccc(cc1)N1CCC(C)(C)CC1
BDBM50181878 COc1cc(CCCN2CCOCC2)ccc1-c1ccc(cc1)C(=O)NS(=O)(=O)c1ccc(NCCSc2ccccc2)c(c1)[N+]([O-])=O
BDBM50181879 COc1cc(CC(=O)N(C)C)ccc1-c1ccc(cc1)C(=O)NS(=O)(=O)c1ccc(NCCSc2ccccc2)c(c1)[N+]([O-])=O
BDBM50181880 CN(C)CCC[C@H](CSc1ccccc1)Nc1ccc(cc1[N+]([O-])=O)S(=O)(=O)NC(=O)c1ccc(cc1)N1CCC(C)(C)CC1
BDBM50181881 COc1cc(CCCN2CCOCC2)ccc1-c1ccc(cc1)C(=O)NS(=O)(=O)c1ccc(N[C@H](CCN2CCOCC2)CSc2ccccc2)c(c1)[N+]([O-])=O
BDBM50181882 COc1cc(CCCN2CCOCC2)ccc1-c1ccc(cc1)C(=O)NS(=O)(=O)c1ccc(N[C@@H](CSc2ccccc2)CC(=O)N(C)C)c(c1)[N+]([O-])=O
BDBM50181883 COc1cc(CCC(=O)N(C)C)ccc1-c1ccc(cc1)C(=O)NS(=O)(=O)c1ccc(NCCSc2ccccc2)c(c1)[N+]([O-])=O
BDBM50181884 [O-][N+](=O)c1cc(ccc1NCCSc1ccccc1)S(=O)(=O)NC(=O)c1ccc(cc1)N1CCOCC1
BDBM50181885 CN(C)C(=O)C[C@H](CSc1ccccc1)Nc1ccc(cc1[N+]([O-])=O)S(=O)(=O)NC(=O)c1ccc(cc1)N1CCC(C)(C)CC1
BDBM50181886 COc1cc(CN(C)C)ccc1-c1ccc(cc1)C(=O)NS(=O)(=O)c1ccc(NCCSc2ccccc2)c(c1)[N+]([O-])=O
BDBM50181887 CC(=O)N1CCN(CC1)c1ccc(cc1)C(=O)NS(=O)(=O)c1ccc(NCCSc2ccccc2)c(c1)[N+]([O-])=O
BDBM50181888 CC1(C)CCN(CC1)c1ccc(cc1)C(=O)NS(=O)(=O)c1ccc(N[C@H](CCN2CCOCC2)CSc2ccccc2)c(c1)[N+]([O-])=O
BDBM50181889 COc1cc(CCCN2CCOCC2)ccc1-c1ccc(cc1)C(=O)NS(=O)(=O)c1ccc(N[C@H](CCCCN)CSc2ccccc2)c(c1)[N+]([O-])=O
BDBM50181890 COc1cc(ccc1-c1ccc(cc1)C(=O)NS(=O)(=O)c1ccc(NCCSc2ccccc2)c(c1)[N+]([O-])=O)C(=O)N(C)C
BDBM50181891 CC1(C)CCN(CC1)c1ccc(cc1)C(=O)NS(=O)(=O)c1ccc(N[C@H](CCCCN)CSc2ccccc2)c(c1)[N+]([O-])=O
BDBM50181892 CC(C)(C)OC(=O)N1CCN(CC1)c1ccc(cc1)C(=O)NS(=O)(=O)c1ccc(NCCSc2ccccc2)c(c1)[N+]([O-])=O
BDBM50181893 COc1cc(CCCN2CCOCC2)ccc1-c1ccc(cc1)C(=O)NS(=O)(=O)c1ccc(N[C@@H](CCN(C)C)CSc2ccccc2)c(c1)[N+]([O-])=O
BDBM50181894 CC1(C)CCN(CC1)c1ccc(cc1)C(=O)NS(=O)(=O)c1ccc(N[C@@H](CCN2CCOCC2)CSc2ccccc2)c(c1)[N+]([O-])=O
BDBM50181895 COc1cc(CCN(C)C)ccc1-c1ccc(cc1)C(=O)NS(=O)(=O)c1ccc(NCCSc2ccccc2)c(c1)[N+]([O-])=O
BDBM50196031 COc1c(Cc2ccccc2C(C)C)cc(C(=O)Nc2ccc(cc2)S(=O)(=O)c2ccccc2C(C)(C)C)c(OC)c1OC
BDBM50196032 CC(C)c1ccccc1Cc1cc(C(=O)Nc2ccc(cc2)S(=O)(=O)c2ccccc2C(C)(C)C)c(O)c(O)c1O
BDBM50196033 CC(C)c1cc(C(=O)Nc2ccccc2)c(O)c(O)c1O
BDBM50196034 CC[C@H](C)[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CC(O)=O)NC(=O)[C@H](CCC(O)=O)NC(=O)[C@@H](N)CCC(N)=O)[C@@H](C)CC)[C@@H](C)CC)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](C(C)C)C(=O)NCC(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](CCCN=C(N)N)C(O)=O |wU:27.27,129.129,35.39,70.70,104.105,143.143,8.12,2.2,118.118,86.85,wD:31.31,75.74,59.59,63.63,43.48,137.137,16.23,109.109,52.52,4.4,159.159,151.151,96.96,(58.76,-35.75,;58.76,-37.29,;57.42,-38.06,;56.09,-37.29,;57.42,-39.6,;58.76,-40.37,;60.09,-39.6,;60.09,-38.06,;61.42,-40.37,;61.42,-41.91,;60.09,-42.68,;60.09,-44.22,;58.76,-41.91,;62.76,-39.6,;64.09,-40.37,;64.09,-41.91,;65.43,-39.6,;65.43,-38.06,;66.76,-37.29,;66.76,-35.75,;68.09,-34.98,;68.09,-33.44,;69.43,-32.67,;66.76,-32.67,;66.76,-40.37,;68.09,-39.6,;68.09,-38.06,;69.43,-40.37,;70.76,-39.6,;72.09,-40.37,;72.09,-41.91,;73.43,-39.6,;74.76,-40.37,;76.09,-39.6,;76.09,-38.06,;77.43,-40.37,;77.43,-41.91,;76.09,-42.68,;74.76,-41.91,;76.09,-44.22,;78.76,-39.6,;80.1,-40.37,;80.1,-41.91,;81.43,-39.6,;81.43,-38.06,;80.1,-37.29,;80.1,-35.75,;78.76,-34.98,;81.43,-34.98,;82.76,-40.37,;84.1,-39.6,;84.1,-38.06,;85.43,-40.37,;85.43,-41.91,;86.76,-39.6,;88.1,-40.37,;89.43,-39.6,;90.77,-40.37,;89.43,-38.06,;73.43,-38.06,;74.76,-37.29,;72.09,-37.29,;72.09,-35.75,;69.43,-41.91,;68.09,-42.68,;70.76,-42.68,;70.76,-44.22,;56.09,-40.37,;56.09,-41.91,;54.76,-39.6,;53.42,-40.37,;53.42,-41.91,;52.09,-39.6,;52.09,-38.06,;50.75,-40.37,;49.42,-39.6,;49.42,-38.06,;48.09,-37.29,;46.75,-38.06,;45.42,-37.29,;45.42,-35.75,;46.75,-34.98,;44.09,-34.98,;48.09,-40.37,;48.99,-41.62,;46.75,-39.6,;45.42,-40.37,;45.42,-41.91,;46.75,-42.68,;46.91,-44.21,;48.42,-44.53,;49.19,-43.2,;48.16,-42.05,;44.09,-39.6,;44.09,-38.06,;42.75,-40.37,;41.42,-39.6,;41.42,-38.06,;40.09,-37.29,;38.75,-38.06,;40.09,-35.75,;40.09,-40.37,;40.09,-41.91,;38.75,-39.6,;37.42,-40.37,;37.42,-41.91,;36.08,-39.6,;36.08,-38.06,;34.75,-40.37,;33.42,-39.6,;33.42,-38.06,;32.08,-37.29,;32.08,-35.75,;30.75,-34.98,;33.42,-34.98,;32.08,-40.37,;32.08,-41.91,;30.75,-39.6,;29.42,-40.37,;29.42,-41.91,;28.08,-42.68,;30.75,-42.68,;28.08,-39.6,;28.08,-38.06,;26.75,-40.37,;25.41,-39.6,;24.08,-40.37,;24.08,-41.91,;22.75,-39.6,;21.41,-40.37,;21.41,-41.91,;20.08,-42.68,;20.08,-44.22,;18.75,-41.91,;20.08,-39.6,;20.08,-38.06,;18.75,-40.37,;17.41,-39.6,;17.41,-38.06,;16.08,-37.29,;16.08,-40.37,;16.08,-41.91,;14.75,-39.6,;13.41,-40.37,;13.41,-41.91,;12.08,-42.68,;12.08,-44.22,;10.74,-44.99,;12.08,-39.6,;12.08,-38.06,;10.74,-40.37,;9.41,-39.6,;9.41,-38.06,;8.08,-37.29,;8.08,-35.75,;6.74,-38.06,;8.08,-40.37,;8.08,-41.91,;6.74,-39.6,;5.41,-40.37,;4.08,-39.6,;2.74,-40.37,;1.41,-39.6,;.08,-40.37,;-1.26,-39.6,;-2.59,-40.37,;-1.26,-38.06,;5.41,-41.91,;4.08,-42.68,;6.74,-42.68,)|
BDBM50196035 Oc1c(O)c(Cc2ccccc2)cc(C(=O)Nc2ccccc2)c1O
BDBM50196036 Oc1c(O)c(Cc2ccccc2)cc(C(=O)Nc2ccc(cc2)S(=O)(=O)c2ccccc2)c1O
BDBM50200961 CCOC(=O)C(C#N)C1C(C(=O)OCC)C(=N)Oc2ccc(CC)cc12
BDBM50200962 CCOC(=O)C(C#N)C1C(C(=O)OCC)C(=N)Oc2ccc(cc12)-c1ccccc1
BDBM50200963 CCCc1ccc2OC(=N)C(C(C(C#N)C(=O)OCC)c2c1)C(=O)OCC
BDBM50200964 CCOC(=O)C(C#N)C1C(C(=O)OCC)C(=N)Oc2ccc(cc12)C1CCCC1
BDBM50200965 CCOC(=O)C(C#N)C1C(C(=O)OCC)C(=N)Oc2ccc(Br)cc12
BDBM50200966 CCOC(=O)C(C#N)C1C(C(=O)OCC)C(=N)Oc2ccccc12
BDBM50200967 CCOC(=O)C(C#N)C1C(C(=O)OCC)C(=N)Oc2ccc(C)cc12
BDBM50202284 C[C@H](N1C(=S)S\C(=C/c2ccc(Br)cc2)C1=O)C(O)=O
BDBM50202269 OC(=O)[C@H](Cc1c[nH]c2ccccc12)N1C(=S)S\C(=C/c2ccc(Br)cc2)C1=O
BDBM50202270 Brc1ccc(\C=C2/SC(=S)N([C@@H](Cc3ccccc3)C(=O)OCC=C)C2=O)cc1
BDBM50202271 CC(C)C[C@H](N1C(=S)S\C(=C(\c2ccccc2)c2ccc(cc2)-c2ccccc2)C1=O)C(O)=O
BDBM50202272 CCC\C(=C1\SC(=S)N([C@@H](Cc2ccccc2)C(O)=O)C1=O)c1ccccc1
BDBM50202273 OC(=O)CC[C@H](N1C(=S)S\C(=C/c2ccc(Br)cc2)C1=O)C(O)=O
BDBM50202274 [#6]-[#6](-[#6])-[#6]-[#6@H](-[#7]-1-[#6](=S)-[#16]\[#6](=[#6](/c2ccccc2)-c2ccccc2)-[#6]-1=O)-[#6](-[#8])=O
BDBM50202275 CCC\C(=C1\SC(=S)N([C@@H](CC(C)C)C(O)=O)C1=O)c1ccccc1
BDBM50202276 [#6]=[#6]-[#6]-[#8]-[#6](=O)-[#6@H](-[#6]-c1ccccc1)-[#7]-1-[#6](=S)-[#16]\[#6](=[#6](/c2ccccc2)-c2ccccc2)-[#6]-1=O
BDBM50202277 OC(=O)[C@H](Cc1ccccc1)N1C(=S)S\C(=C/c2ccc(Br)cc2)C1=O
BDBM50202278 CSCC[C@H](N1C(=S)S\C(=C/c2ccc(Br)cc2)C1=O)C(O)=O
BDBM50202280 CC(C)C(N1C(=S)S\C(=C\c2ccc(Br)cc2)C1=O)C(O)=O |w:3.20|
BDBM50202281 C[C@H](N1C(=S)S\C(=C/c2ccc(Br)cc2)C1=O)C(=O)OCC=C
BDBM50202282 CC(C)C[C@H](N1C(=S)S\C(=C(\C)c2ccccc2)C1=O)C(O)=O
BDBM50202283 CC(C)C[C@H](N1C(=S)S\C(=C/c2ccc(Br)cc2)C1=O)C(O)=O
BDBM50202285 C[C@H](N1C(=S)S\C(=C/c2ccc(Br)cc2)C1=O)C(=O)N1CCOCC1
BDBM50208819 CN(CCCc1ccccc1)S(=O)(=O)c1cc(C(=O)N2CCc3ccc(cc3C2)S(=O)(=O)NCCc2ccccc2)c(O)c(O)c1O
BDBM50206434 Oc1ccc2C(=O)c3ccccc3C(=O)c2c1O
BDBM50208820 CC(C)c1cc(C(=O)N2CCc3ccccc3C2)c(O)c(O)c1O
BDBM50208821 CC(C)c1cc(C(=O)N2CCc3ccc(cc3C2)S(=O)(=O)NCCc2ccccc2)c(O)c(O)c1O
BDBM50214870 CC(C)Cc1c(O)c(O)c(O)c2c1oc(C)cc2=O
BDBM50214871 CC(C)Cc1c(O)c(O)c(O)c2c1oc(C)c(-c1ccc(cc1)-c1c(C)oc3c(CC(C)C)c(O)c(O)c(O)c3c1=O)c2=O
BDBM50214872 CC(C)Cc1c(O)c(O)c(O)c2c1oc(C)c(-c1ccccc1)c2=O
BDBM50265689 [#6]-[#6]-[#6]-[#6]-[#6@H](-[#7]-[#6](=O)-[#6@H](-[#6]-[#6]-[#6](-[#7])=O)-[#7]-[#6](=O)-[#6]-[#7])-[#6](=O)-[#7]-[#6]-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#6]\[#7]=[#6](\[#7])-[#7])-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#6](-[#7])=O)-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6](-[#6])-[#6])-[#6](=O)-[#7]-[#6@@H](-[#6])-[#6](=O)-[#7]-[#6@@H](-[#6@@H](-[#6])-[#6]-[#6])-[#6](=O)-[#7]-[#6@@H](-[#6@@H](-[#6])-[#6]-[#6])-[#6](=O)-[#7]-[#6]-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6](-[#8])=O)-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6](-[#8])=O)-[#6](=O)-[#7]-[#6@@H](-[#6@@H](-[#6])-[#6]-[#6])-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6](-[#7])=O)-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#6]\[#7]=[#6](/[#7])-[#7])-[#6](-[#8])=O |r|
BDBM50265691 [#6]-[#6]-[#6@H](-[#6])-[#6@H](-[#7]-[#6](=O)-[#6@@H](-[#7]-[#6](=O)-[#6@H](-[#6])-[#7]-[#6](=O)-[#6@H](-[#6]-[#6](-[#6])-[#6])-[#7]-[#6](=O)-[#6@H](-[#6]-[#6]-[#6](-[#7])=O)-[#7]-[#6](=O)-[#6@H](-[#6]-[#6]-[#6]\[#7]=[#6](\[#7])-[#7])-[#7]-[#6](=O)-[#6]-[#7]-[#6](=O)-[#6@H](-[#6]-c1ccc2ccccc2c1)-[#7]-[#6](=O)-[#6@H](-[#6]-[#6]-[#6](-[#7])=O)-[#7]-[#6](=O)-[#6]-[#7])-[#6@@H](-[#6])-[#6]-[#6])-[#6](=O)-[#7]-[#6]-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6](-[#8])=O)-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6](-[#8])=O)-[#6](=O)-[#7]-[#6@@H](-[#6@@H](-[#6])-[#6]-[#6])-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6](-[#7])=O)-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#6]\[#7]=[#6](/[#7])-[#7])-[#6](-[#8])=O |r|
BDBM50265695 [#6]-[#6]-[#6@H](-[#6])-[#6@H](-[#7]-[#6](=O)-[#6@@H](-[#7]-[#6](=O)-[#6@H](-[#6])-[#7]-[#6](=O)-[#6@H](-[#6]-c1ccc2ccccc2c1)-[#7]-[#6](=O)-[#6@H](-[#6]-[#6]-[#6](-[#7])=O)-[#7]-[#6](=O)-[#6@H](-[#6]-[#6]-[#6]\[#7]=[#6](/[#7])-[#7])-[#7]-[#6](=O)-[#6]-[#7]-[#6](=O)-[#6@@H](-[#7]-[#6](=O)-[#6@H](-[#6]-[#6]-[#6](-[#7])=O)-[#7]-[#6](=O)-[#6]-[#7])-[#6](-[#6])-[#6])-[#6@@H](-[#6])-[#6]-[#6])-[#6](=O)-[#7]-[#6]-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6](-[#8])=O)-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6](-[#8])=O)-[#6](=O)-[#7]-[#6@@H](-[#6@@H](-[#6])-[#6]-[#6])-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6](-[#7])=O)-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#6]\[#7]=[#6](/[#7])-[#7])-[#6](-[#8])=O |r|
BDBM50265708 [#6]-[#6]-[#6@H](-[#6])-[#6@H](-[#7]-[#6](=O)-[#6@@H](-[#7]-[#6](=O)-[#6@H](-[#6])-[#7]-[#6](=O)-[#6@H](-[#6]-[#6]-[#16]-[#6])-[#7]-[#6](=O)-[#6@H](-[#6]-[#6]-[#6](-[#7])=O)-[#7]-[#6](=O)-[#6@H](-[#6]-[#6]-[#6]\[#7]=[#6](/[#7])-[#7])-[#7]-[#6](=O)-[#6]-[#7]-[#6](=O)-[#6@@H](-[#7]-[#6](=O)-[#6@H](-[#6]-[#6]-[#6](-[#7])=O)-[#7]-[#6](=O)-[#6]-[#7])-[#6](-[#6])-[#6])-[#6@@H](-[#6])-[#6]-[#6])-[#6](=O)-[#7]-[#6]-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6](-[#8])=O)-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6](-[#8])=O)-[#6](=O)-[#7]-[#6@@H](-[#6@@H](-[#6])-[#6]-[#6])-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6](-[#7])=O)-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#6]\[#7]=[#6](/[#7])-[#7])-[#6](-[#8])=O |r|
BDBM50265712 CC[C@H](C)[C@H](NC(=O)[C@H](C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCN=C(N)N)NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](CCC(N)=O)NC(=O)CN)C(C)C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NCC(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H]([C@@H](C)CC)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCCN=C(N)N)C(O)=O |r,wU:101.103,45.45,92.93,13.17,108.109,4.4,30.37,wD:49.54,2.2,8.8,84.85,21.26,100.101,66.65,116.117,(21.27,-3.15,;21.28,-4.69,;22.61,-5.46,;23.94,-4.68,;22.61,-7,;21.28,-7.77,;19.94,-7.01,;19.94,-5.47,;18.61,-7.78,;18.61,-9.32,;17.28,-7,;15.94,-7.77,;15.94,-9.31,;14.61,-7,;14.61,-5.46,;15.94,-4.69,;15.94,-3.15,;17.27,-5.46,;13.28,-7.78,;11.94,-7.02,;11.94,-5.48,;10.6,-7.79,;10.6,-9.33,;9.27,-10.1,;9.27,-11.64,;7.93,-12.41,;10.6,-12.41,;9.27,-7.01,;7.94,-7.77,;7.94,-9.31,;6.6,-7,;6.6,-5.46,;7.94,-4.69,;7.94,-3.15,;9.27,-2.39,;9.25,-.85,;7.92,-.08,;10.6,-.08,;5.27,-7.77,;3.93,-7,;3.93,-5.46,;2.6,-7.77,;1.27,-6.99,;-.07,-7.76,;-.07,-9.3,;-1.4,-6.99,;-2.73,-7.77,;-4.08,-7.02,;-4.08,-5.48,;-5.41,-7.79,;-5.41,-9.33,;-6.75,-10.1,;-6.75,-11.64,;-8.08,-12.41,;-5.41,-12.41,;-6.74,-7.02,;-8.08,-7.79,;-8.08,-9.33,;-9.41,-7.02,;-10.75,-7.79,;-1.4,-5.45,;-.07,-4.68,;-2.74,-4.68,;23.95,-7.77,;23.95,-9.31,;25.28,-6.99,;26.61,-7.77,;26.61,-9.31,;27.95,-10.08,;29.36,-9.45,;30.39,-10.59,;29.62,-11.92,;30.09,-13.38,;29.07,-14.52,;27.56,-14.2,;27.09,-12.74,;28.11,-11.6,;27.95,-7,;27.95,-5.46,;29.28,-7.76,;30.61,-6.98,;31.94,-7.75,;31.94,-9.29,;33.29,-6.99,;34.62,-7.76,;34.62,-9.3,;35.96,-10.07,;37.3,-9.31,;35.96,-11.61,;35.96,-6.99,;35.96,-5.45,;37.29,-7.77,;38.61,-6.99,;38.62,-5.44,;39.95,-4.67,;41.29,-5.44,;39.96,-3.13,;39.95,-7.76,;39.95,-9.3,;41.29,-7,;42.62,-7.77,;42.62,-9.31,;43.96,-10.08,;41.29,-10.08,;41.29,-11.62,;43.96,-7,;43.96,-5.46,;45.29,-7.77,;46.62,-7,;46.62,-5.46,;47.96,-4.69,;49.3,-5.46,;47.96,-3.15,;47.96,-7.77,;47.96,-9.31,;49.29,-6.99,;50.62,-7.77,;50.62,-9.31,;51.96,-10.08,;51.96,-11.62,;53.29,-12.39,;53.29,-13.93,;51.97,-14.7,;54.63,-14.7,;51.96,-7,;53.29,-7.77,;51.96,-5.46,)|
BDBM50265713 [#6]-[#6]-[#6@H](-[#6])-[#6@H](-[#7]-[#6](=O)-[#6@H](-[#6])-[#7]-[#6](=O)-[#6@H](-[#6]-[#6](-[#6])-[#6])-[#7]-[#6](=O)-[#6@H](-[#6]-[#6]-[#6](-[#7])=O)-[#7]-[#6](=O)-[#6@H](-[#6]-[#6]-[#6]\[#7]=[#6](/[#7])-[#7])-[#7]-[#6](=O)-[#6]-[#7]-[#6](=O)-[#6@@H](-[#7]-[#6](=O)-[#6@H](-[#6]-[#6]-[#6](-[#7])=O)-[#7]-[#6](=O)-[#6]-[#7])-[#6](-[#6])-[#6])-[#6](=O)-[#7]-[#6@@H](-[#6]-c1ccc(cc1)-c1ccccc1)-[#6](=O)-[#7]-[#6]-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6](-[#8])=O)-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6](-[#8])=O)-[#6](=O)-[#7]-[#6@@H](-[#6@@H](-[#6])-[#6]-[#6])-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6](-[#7])=O)-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#6]\[#7]=[#6](/[#7])-[#7])-[#6](-[#8])=O |r|
BDBM50265716 [#6]-[#6]-[#6@H](-[#6])-[#6@H](-[#7]-[#6](=O)-[#6@@H](-[#7]-[#6](=O)-[#6@H](-[#6])-[#7]-[#6](=O)-[#6@H](-[#6]-[#6](-[#6])-[#6])-[#7]-[#6](=O)-[#6@H](-[#6]-[#6]-[#6](-[#7])=O)-[#7]-[#6](=O)-[#6@H](-[#6]-[#6]-[#6]\[#7]=[#6](\[#7])-[#7])-[#7]-[#6](=O)-[#6]-[#7]-[#6](=O)-[#6@@H](-[#7]-[#6](=O)-[#6@H](-[#6]-[#6]-[#6](-[#7])=O)-[#7]-[#6](=O)-[#6]-[#7])-[#6](-[#6])-[#6])-[#6@@H](-[#6])-[#6]-[#6])-[#6](=O)-[#7]-[#6]-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6](-[#8])=O)-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6](-[#8])=O)-[#6](=O)-[#7]-[#6@@H](-[#6]-c1ccc(Cl)cc1)-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6](-[#7])=O)-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#6]\[#7]=[#6](/[#7])-[#7])-[#6](-[#8])=O |r|
BDBM50265723 [#6]-[#6]-[#6@H](-[#6])-[#6@H](-[#7]-[#6](=O)-[#6@@H](-[#7]-[#6](=O)-[#6@H](-[#6])-[#7]-[#6](=O)-[#6@H](-[#6]-[#6](-[#6])-[#6])-[#7]-[#6](=O)-[#6@H](-[#6]-[#6]-[#6](-[#7])=O)-[#7]-[#6](=O)-[#6@H](-[#6]-[#6]-[#6]\[#7]=[#6](\[#7])-[#7])-[#7]-[#6](=O)-[#6]-[#7]-[#6](=O)-[#6@@H](-[#7]-[#6](=O)-[#6@H](-[#6]-[#6]-[#6](-[#7])=O)-[#7]-[#6](=O)-[#6]-[#7])-[#6](-[#6])-[#6])-[#6@@H](-[#6])-[#6]-[#6])-[#6](=O)-[#7]-[#6]-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6](-[#8])=O)-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6](-[#8])=O)-[#6](=O)-[#7]-[#6@@H](-[#6]-c1ccc(cc1)-[#7+](-[#8-])=O)-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6](-[#7])=O)-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#6]\[#7]=[#6](/[#7])-[#7])-[#6](-[#8])=O |r|
BDBM50259495 CN(C)CCNC(=O)[C@@H]1[C@@H](CO)[C@@H]2Cn3c(cccc3=O)[C@H]1N2c1nc(c(s1)-c1ccccc1)-c1ccc(Cl)cc1 |r|
BDBM50259496 CN(C)CCNC(=O)[C@H]1[C@H](CO)[C@H]2Cn3c(cccc3=O)[C@@H]1N2c1nc(c(s1)-c1ccccc1)-c1ccc(Cl)cc1 |r|
BDBM50259497 OC[C@H]1[C@@H]2Cn3c(cccc3=O)[C@H]([C@@H]1C(=O)NCCN1CCCCC1)N2c1nc(c(s1)-c1ccccc1)-c1ccc(Cl)cc1 |r|
BDBM50259498 OC[C@@H]1[C@H]2Cn3c(cccc3=O)[C@@H]([C@H]1C(=O)NCCN1CCCCC1)N2c1nc(c(s1)-c1ccccc1)-c1ccc(Cl)cc1 |r|
BDBM50259499 OC[C@H]1[C@@H]2Cn3c(cccc3=O)[C@H]([C@@H]1C(=O)NCCCN1CCCC1)N2c1nc(c(s1)-c1ccccc1)-c1ccc(Cl)cc1 |r|
BDBM50259500 OC[C@@H]1[C@H]2Cn3c(cccc3=O)[C@@H]([C@H]1C(=O)NCCCN1CCCC1)N2c1nc(c(s1)-c1ccccc1)-c1ccc(Cl)cc1 |r|
BDBM50259501 COCCNC(=O)[C@@H]1[C@@H](CO)[C@@H]2Cn3c(cccc3=O)[C@H]1N2c1nc(c(s1)-c1ccccc1)-c1ccc(Cl)cc1 |r|
BDBM50259502 COCCNC(=O)[C@H]1[C@H](CO)[C@H]2Cn3c(cccc3=O)[C@@H]1N2c1nc(c(s1)-c1ccccc1)-c1ccc(Cl)cc1 |r|
BDBM50259503 OC[C@@H]1[C@H]2Cn3c(cccc3=O)[C@H]2N(CC2CCCCC2)[C@H]1C(=O)N[C@H]1CCN(Cc2ccccc2)C1 |r|
BDBM50259504 OC[C@@H]1[C@H]2Cn3c(cccc3=O)[C@H]2N(CC2CCCCC2)[C@H]1C(=O)NC1Cc2ccccc2C1 |r|
BDBM50259505 OC[C@@H]1[C@H]2Cn3c(cccc3=O)[C@H]2N(CC2CCCCC2)[C@H]1C(=O)N[C@@H]1CCN(Cc2ccccc2)C1 |r|
BDBM50259506 OC[C@@H]1[C@H]2Cn3c(cccc3=O)[C@H]2N(CC2CCCCC2)[C@H]1C(=O)NCc1ccc(Oc2ccccc2)cc1 |r|
BDBM50259507 OC[C@H]1[C@@H]2Cn3c(cccc3=O)[C@@H]2N(Cc2ccc(Cl)c(Cl)c2)[C@@H]1C(=O)N1CCC(Cc2ccccc2)CC1 |r|
BDBM50259508 OC[C@H]1[C@@H]2Cn3c(cccc3=O)[C@@H]2N(Cc2ccc(Cl)c(Cl)c2)[C@@H]1C(=O)N1CCC(CC1)c1ccc(F)cc1 |r|
BDBM50259509 OC[C@H]1[C@@H]2Cn3c(cccc3=O)[C@@H]2N(Cc2ccc(Oc3ccccc3)cc2)[C@@H]1C(=O)N1CCC(Cc2ccccc2)CC1 |r|
BDBM50259510 OC[C@H]1[C@@H]2Cn3c(cccc3=O)[C@@H]2N(Cc2ccc(Oc3ccccc3)cc2)[C@@H]1C(=O)N1CCC(CC1)c1ccc(F)cc1 |r|
BDBM50254595 CCCCN(CCCC)C(=O)c1cc(C)n(n1)-c1ccc(NC(=O)CSc2ccccc2)cc1C(=O)N1CCc2ccccc2C1
BDBM50254596 CCCCN(CCCC)C(=O)c1cc(C)n(n1)-c1ccc(NC(=O)COc2ccccc2)cc1C(=O)N1CCc2ccccc2C1
BDBM50254576 Cc1cc(nn1-c1ccccc1C(=O)N1CCc2ccccc2C1)C(=O)N1CCc2ccccc2C1
BDBM50254577 Cc1cc(nn1-c1ccccc1C(=O)N1CCc2ccccc2C1)C(=O)Nc1ccccc1
BDBM50254578 CN(C(=O)c1cc(C)n(n1)-c1ccccc1C(=O)N1CCc2ccccc2C1)c1cccc(F)c1
BDBM50254579 CN(C(=O)c1cc(C)n(n1)-c1ccccc1C(=O)N1CCc2ccccc2C1)c1ccccc1F
BDBM50254580 CCN(C(=O)c1cc(C)n(n1)-c1ccccc1C(=O)N1CCc2ccccc2C1)c1ccccc1
BDBM50254581 CC(C)N(C(=O)c1cc(C)n(n1)-c1ccccc1C(=O)N1CCc2ccccc2C1)c1ccccc1
BDBM50254582 C[C@@H]1Cc2ccccc2CN1C(=O)c1ccccc1-n1nc(cc1C)C(=O)N(c1ccccc1)c1ccccc1 |r|
BDBM50254583 Cc1c(Br)c(nn1-c1ccccc1C(=O)N1Cc2ccccc2C[C@H]1CO)C(=O)N(c1ccccc1)c1ccccc1 |r|
BDBM50254584 Cc1c(Cl)c(nn1-c1ccccc1C(=O)N1Cc2ccccc2C[C@H]1CO)C(=O)N(c1ccccc1)c1ccccc1 |r|
BDBM50254585 Cc1c(Cl)c(nn1-c1ccccc1C(=O)N1Cc2ccccc2C[C@H]1CN)C(=O)N(c1ccccc1)c1ccccc1 |r|
BDBM50254586 CCN(CC)C(=O)c1nn(c(C)c1Br)-c1ccccc1C(=O)N1Cc2ccccc2C[C@H]1CO |r|
BDBM50254587 CCCCN(CCCC)C(=O)c1nn(c(C)c1Cl)-c1ccccc1C(=O)N1Cc2ccccc2C[C@H]1CN |r|
BDBM50254588 CCCCN(CCCC)C(=O)c1nn(c(C)c1Cl)-c1ccc(N)cc1C(=O)N1CCc2ccccc2C1
BDBM50254589 CCCCN(CCCC)C(=O)c1nn(c(C)c1Cl)-c1ccc(NC(=O)c2ccccc2)cc1C(=O)N1CCc2ccccc2C1
BDBM50254590 CCCCN(CCCC)C(=O)c1nn(c(C)c1Cl)-c1ccc(NC(=O)Cc2ccccc2)cc1C(=O)N1CCc2ccccc2C1
BDBM50254591 CCCCN(CCCC)C(=O)c1nn(c(C)c1Cl)-c1ccc(NC(=O)COc2ccccc2)cc1C(=O)N1CCc2ccccc2C1
BDBM50254592 CCCCN(CCCC)C(=O)c1nn(c(C)c1Cl)-c1ccc(NS(=O)(=O)Cc2ccccc2)cc1C(=O)N1CCc2ccccc2C1
BDBM50254527 Cc1cc(nn1-c1ccccc1C(=O)N1Cc2ccccc2C[C@H]1CNS(C)(=O)=O)C(=O)N(c1ccccc1)c1ccccc1 |r|
BDBM50254528 CCOC(=O)[C@@H]1Cc2ccccc2CN1C(=O)c1ccccc1-n1nc(cc1C)C(=O)N(c1ccccc1)c1ccccc1 |r|
BDBM50254529 COC(=O)C[C@@H]1Cc2ccccc2CN1C(=O)c1ccccc1-n1nc(cc1C)C(=O)N(c1ccccc1)c1ccccc1 |r|
BDBM50254530 CN(C)C[C@@H]1Cc2ccccc2CN1C(=O)c1ccccc1-n1nc(cc1C)C(=O)N(c1ccccc1)c1ccccc1 |r|
BDBM50254531 CNC[C@@H]1Cc2ccccc2CN1C(=O)c1ccccc1-n1nc(cc1C)C(=O)N(c1ccccc1)c1ccccc1 |r|
BDBM50254533 CCCCN(CCCC)C(=O)c1cc(C)n(n1)-c1ccccc1C(=O)N1CCc2ccccc2C1
BDBM50254534 CCCCN(CCCC)C(=O)c1nn(c(C)c1Cl)-c1ccccc1C(=O)N1Cc2ccccc2C[C@H]1CO |r|
BDBM50254535 CCCCN(CCCC)C(=O)c1nn(c(C)c1Cl)-c1ccc(N)cc1C(=O)N1Cc2ccccc2C[C@H]1CN |r|
BDBM50254536 CCCCN(CCCC)C(=O)c1nn(c(C)c1Cl)-c1ccc(NC(=O)COc2ccccc2)cc1C(=O)N1Cc2ccccc2C[C@H]1CN |r|
BDBM50254537 CCCCN(CCCC)C(=O)c1nn(c(C)c1Cl)-c1ccc(NCc2ccncc2)cc1C(=O)N1Cc2ccccc2C[C@H]1CN |r|
BDBM50254593 CCCCN(CCCC)C(=O)c1cc(C)n(n1)-c1ccc(OCC(=O)c2ccccc2)cc1C(=O)N1CCc2ccccc2C1
BDBM50254518 CN(C(=O)c1cc(C)n(n1)-c1ccccc1C(=O)N1CCc2ccccc2C1)c1ccccc1
BDBM50254519 CN(C(=O)c1cc(C)n(n1)-c1ccccc1C(=O)N1CCc2ccccc2C1)c1ccc(F)cc1
BDBM50254521 Cc1cc(nn1-c1ccccc1C(=O)N1CCc2ccccc2C1)C(=O)N(C1CCCCC1)c1ccccc1
BDBM50254522 Cc1cc(nn1-c1ccccc1C(=O)N1CCc2ccccc2C1)C(=O)N(c1ccccc1)c1ccccc1
BDBM50254523 Cc1cc(nn1-c1ccccc1C(=O)N1Cc2ccccc2C[C@H]1CO)C(=O)N(c1ccccc1)c1ccccc1 |r|
BDBM50254524 Cc1cc(nn1-c1ccccc1C(=O)N1Cc2ccccc2C[C@H]1CN)C(=O)N(c1ccccc1)c1ccccc1 |r|
BDBM50254525 COC[C@@H]1Cc2ccccc2CN1C(=O)c1ccccc1-n1nc(cc1C)C(=O)N(c1ccccc1)c1ccccc1 |r|
BDBM50254526 CC(=O)NC[C@@H]1Cc2ccccc2CN1C(=O)c1ccccc1-n1nc(cc1C)C(=O)N(c1ccccc1)c1ccccc1 |r|
BDBM50254594 CCCCN(CCCC)C(=O)c1cc(C)n(n1)-c1ccc(OCC(O)=O)cc1C(=O)N1CCc2ccccc2C1
BDBM50247979 Cc1cc(nn1-c1cccc(C)c1C(=O)N1Cc2ccccc2CC1CO)C(=O)N(c1ccccc1)c1ccccc1
BDBM50247980 Cc1cc(nn1-c1cccc(C)c1C(=O)N1Cc2ccccc2C[C@@H]1CO)C(=O)N(c1ccccc1)c1ccccc1 |r|
BDBM50247981 Cc1cc(nn1-c1cccc(C)c1C(=O)N1Cc2ccccc2C[C@H]1CO)C(=O)N(c1ccccc1)c1ccccc1 |r|
BDBM50247982 CCCCN(CCCC)C(=O)c1cc(C)n(n1)-c1cccc(C)c1C(=O)N1Cc2ccccc2C[C@H]1CN |r|
BDBM50248005 CCCCN(CCCC)C(=O)c1nn(c(C)c1Cl)-c1cccc(C)c1C(=O)N1Cc2ccccc2C[C@H]1CN |r|
BDBM50248006 CCCCN(CCCC)C(=O)c1cc(C)n(n1)-c1cccc(Cl)c1C(=O)N1Cc2ccccc2C[C@H]1CN |r|
BDBM50270875 Oc1cccc2CCCCc12
BDBM50270877 CC1(C)CCC(=C(CN2CCN(CC2)c2ccc(cc2)C(=O)NS(=O)(=O)c2ccc(N[C@H](CCN3CCOCC3)CSc3ccccc3)c(c2)S(=O)(=O)C(F)(F)F)C1)c1ccc(Cl)cc1 |r,t:5|
BDBM50274326 CN(C)CC[C@H](CSc1ccccc1)Nc1ccc(cc1[N+]([O-])=O)S(=O)(=O)NC(=O)c1ccc(cc1)N1CCN(CC2=C(CCOC2)c2ccc(Cl)cc2)CC1 |r,t:44|
BDBM50316671 C[C@H](CNC(=O)c1c(O)c(O)cc2c(O)c(c(C)cc12)-c1c(C)cc2c(C(=O)NC[C@@H](C)c3ccccc3)c(O)c(O)cc2c1O)c1ccccc1 |r,wU:30.32,wD:1.0,(20.84,-14.32,;21.62,-15.64,;23.16,-15.63,;23.92,-14.29,;25.46,-14.28,;26.24,-15.61,;26.22,-12.94,;25.44,-11.62,;23.9,-11.64,;26.19,-10.28,;25.41,-8.96,;27.74,-10.27,;28.52,-11.6,;30.05,-11.59,;30.8,-10.25,;30.82,-12.9,;30.06,-14.24,;30.84,-15.57,;28.53,-14.25,;27.76,-12.93,;32.36,-12.89,;33.14,-14.22,;32.38,-15.56,;34.68,-14.21,;35.44,-12.86,;36.98,-12.84,;37.77,-14.16,;37.01,-15.51,;39.31,-14.14,;40.09,-15.47,;41.63,-15.45,;42.39,-14.1,;42.42,-16.77,;41.66,-18.11,;42.45,-19.43,;43.99,-19.42,;44.74,-18.06,;43.95,-16.74,;37.73,-11.49,;39.27,-11.47,;36.94,-10.16,;37.68,-8.82,;35.4,-10.19,;34.65,-11.53,;33.11,-11.55,;32.33,-10.23,;20.86,-16.98,;19.32,-16.99,;18.56,-18.33,;19.33,-19.67,;20.87,-19.66,;21.64,-18.32,)|
BDBM50316672 C[C@@H](CNC(=O)c1c(O)c(O)cc2c(O)c(c(C)cc12)-c1c(C)cc2c(C(=O)NC[C@H](C)c3ccccc3)c(O)c(O)cc2c1O)c1ccccc1 |r,wU:1.0,wD:30.32,(19.56,-.32,;20.34,-1.65,;21.88,-1.63,;22.64,-.3,;24.18,-.29,;24.96,-1.61,;24.94,1.05,;24.16,2.37,;22.62,2.36,;24.91,3.71,;24.13,5.04,;26.46,3.73,;27.24,2.4,;28.76,2.41,;29.52,3.75,;29.54,1.1,;28.79,-.25,;29.56,-1.58,;27.25,-.26,;26.48,1.07,;31.08,1.1,;31.86,-.23,;31.1,-1.56,;33.4,-.21,;34.16,1.14,;35.7,1.15,;36.49,-.17,;35.73,-1.51,;38.03,-.15,;38.81,-1.47,;40.35,-1.45,;41.11,-.11,;41.14,-2.78,;40.38,-4.11,;41.17,-5.44,;42.71,-5.42,;43.46,-4.07,;42.68,-2.75,;36.45,2.5,;37.99,2.53,;35.65,3.83,;36.4,5.18,;34.12,3.8,;33.37,2.47,;31.83,2.44,;31.05,3.76,;19.58,-2.99,;18.04,-3,;17.27,-4.33,;18.05,-5.67,;19.59,-5.66,;20.36,-4.32,)|
BDBM50318189 COc1ccccc1C1C2=C(N=c3s\c(=C/c4cccc(OCC(O)=O)c4)c(=O)n13)c1ccccc1CC2 |c:10,t:12|
BDBM50318190 COc1ccc(cc1)C1C2=C(N=c3s\c(=C/c4ccc(OCc5cccc(c5)C(O)=O)c(OC)c4)c(=O)n13)c1ccccc1CC2 |c:10,t:12|
BDBM50318191 OC(=O)c1cccc(c1)-c1ccc(\C=c2/sc3=NC4=C(CCc5ccccc45)C(c4cccc(F)c4)n3c2=O)o1 |t:17,19|
BDBM50318192 COc1ccc(cc1)C1C2=C(N=c3s\c(=C/c4ccc(o4)-c4cccc(c4)C(O)=O)c(=O)n13)c1ccccc1CC2 |c:10,t:12|
BDBM50318193 COc1cccc(c1)C1C2=C(N=c3s\c(=C/c4ccc(o4)-c4cccc(c4)C(O)=O)c(=O)n13)c1ccccc1CC2 |c:10,t:12|
BDBM50339777 CN(C)CC[C@H](CSc1ccccc1)Nc1ccc(cc1[N+]([O-])=O)S(=O)(=O)Nc1ncnc2cc(ccc12)N1CCN(Cc2ccccc2-c2ccc(Cl)cc2)CC1 |r|
BDBM50339778 [O-][N+](=O)c1cc(ccc1N[C@H](CCN1CCOCC1)CSc1ccccc1)S(=O)(=O)Nc1ncnc2cc(ccc12)N1CCN(Cc2ccccc2-c2ccc(Cl)cc2)CC1 |r|
BDBM50339779 CN(C)CC[C@H](CSc1ccccc1)Nc1ccc(cc1S(=O)(=O)C(F)(F)F)S(=O)(=O)Nc1ncnc2cc(ccc12)N1CCN(Cc2ccccc2-c2ccc(Cl)cc2)CC1 |r|
BDBM50339780 FC(F)(F)S(=O)(=O)c1cc(ccc1N[C@H](CCN1CCOCC1)CSc1ccccc1)S(=O)(=O)Nc1ncnc2cc(ccc12)N1CCN(Cc2ccccc2-c2ccc(Cl)cc2)CC1 |r|
BDBM50339781 CN(C)CC[C@H](CSc1ccccc1)Nc1ccc(cc1[N+]([O-])=O)S(=O)(=O)Nc1ncnc2cc(ccc12)N1CCN(CC2=C(CCC(C)(C)C2)c2ccc(Cl)cc2)CC1 |r,t:47|
BDBM50339782 CC1(C)CCC(=C(CN2CCN(CC2)c2ccc3c(NS(=O)(=O)c4ccc(N[C@H](CCN5CCOCC5)CSc5ccccc5)c(c4)[N+]([O-])=O)ncnc3c2)C1)c1ccc(Cl)cc1 |r,t:5|
BDBM50339783 CN(C)CC[C@H](CSc1ccccc1)Nc1ccc(cc1S(=O)(=O)C(F)(F)F)S(=O)(=O)Nc1ncnc2cc(ccc12)N1CCN(CC2=C(CCC(C)(C)C2)c2ccc(Cl)cc2)CC1 |r,t:51|
BDBM50339776 CC1(C)CCC(=C(CN2CCN(CC2)c2ccc3c(NS(=O)(=O)c4ccc(N[C@H](CCN5CCOCC5)CSc5ccccc5)c(c4)S(=O)(=O)C(F)(F)F)ncnc3c2)C1)c1ccc(Cl)cc1 |r,t:5|
BDBM50330252 Oc1cc2c(O)c(-c3c(O)c4cc(O)c(O)c(=CC5CCCC5)c4c(O)c3=C)c(=C)c(O)c2c(=CC2CCCC2)c1O |w:34.38,17.17,(-10.24,1.31,;-8.91,.55,;-7.57,1.33,;-6.23,.55,;-4.9,1.33,;-4.9,2.87,;-3.55,.55,;-2.22,1.32,;-.89,.54,;-.89,-1,;.44,1.3,;1.76,.52,;3.11,1.27,;4.43,.49,;3.12,2.82,;4.47,3.58,;1.79,3.61,;1.8,5.15,;3.14,5.91,;4.38,5,;5.63,5.9,;5.16,7.36,;3.62,7.37,;.45,2.85,;-.88,3.62,;-.88,5.16,;-2.22,2.85,;-3.56,3.62,;-3.55,-1,;-2.22,-1.77,;-4.89,-1.77,;-4.89,-3.31,;-6.23,-1,;-7.57,-1.77,;-7.57,-3.31,;-8.91,-4.08,;-10.18,-3.19,;-11.41,-4.12,;-10.91,-5.57,;-9.37,-5.55,;-8.91,-1,;-10.24,-1.77,)|
BDBM50330253 Oc1cc2c(O)c(-c3c(O)c4cc(O)c(O)c(=CCC5CCCCC5)c4c(O)c3=C)c(=C)c(O)c2c(=CCC2CCCCC2)c1O |w:36.40,17.17,(6.04,-1.44,;7.37,-2.21,;8.7,-1.43,;10.04,-2.21,;11.38,-1.43,;11.37,.11,;12.72,-2.2,;14.05,-1.44,;15.39,-2.21,;15.38,-3.75,;16.71,-1.45,;18.03,-2.23,;19.38,-1.48,;20.7,-2.26,;19.39,.07,;20.73,.82,;18.06,.86,;18.07,2.4,;19.41,3.15,;19.42,4.69,;20.78,5.44,;20.79,6.98,;19.47,7.76,;18.13,7.01,;18.11,5.47,;16.72,.09,;15.39,.87,;15.39,2.4,;14.05,.1,;12.72,.87,;12.72,-3.75,;14.05,-4.52,;11.38,-4.52,;11.38,-6.06,;10.05,-3.75,;8.7,-4.52,;8.7,-6.06,;7.36,-6.83,;7.36,-8.37,;6.03,-9.13,;6.02,-10.66,;7.35,-11.44,;8.69,-10.68,;8.7,-9.13,;7.37,-3.75,;6.04,-4.52,)|
BDBM50330254 Oc1cc2c(O)c(-c3c(O)c4cc(O)c(O)c(=CCc5ccccc5)c4c(O)c3=C)c(=C)c(O)c2c(=CCc2ccccc2)c1O |w:36.40,17.17,(22.56,-1.64,;23.9,-2.4,;25.23,-1.62,;26.57,-2.4,;27.9,-1.62,;27.9,-.08,;29.25,-2.4,;30.58,-1.63,;31.91,-2.41,;31.91,-3.95,;33.23,-1.65,;34.56,-2.43,;35.91,-1.68,;37.23,-2.46,;35.92,-.13,;37.26,.63,;34.59,.66,;34.6,2.2,;35.94,2.96,;35.95,4.5,;37.3,5.25,;37.31,6.79,;35.98,7.57,;34.64,6.81,;34.63,5.27,;33.25,-.1,;31.92,.67,;31.92,2.21,;30.58,-.1,;29.24,.67,;29.25,-3.95,;30.58,-4.72,;27.91,-4.72,;27.91,-6.26,;26.57,-3.95,;25.23,-4.72,;25.23,-6.26,;23.89,-7.03,;23.89,-8.57,;22.55,-9.33,;22.55,-10.87,;23.88,-11.64,;25.22,-10.86,;25.22,-9.33,;23.9,-3.95,;22.56,-4.72,)|
BDBM50330255 Oc1cc2c(O)c(-c3c(O)c4cc(O)c(O)c(=CCCc5ccccc5)c4c(O)c3=C)c(=C)c(O)c2c(=CCCc2ccccc2)c1O |w:37.41,17.17,(4.3,-20.93,;5.64,-21.7,;6.97,-20.92,;8.31,-21.7,;9.65,-20.92,;9.64,-19.38,;10.99,-21.69,;12.32,-20.93,;13.66,-21.7,;13.65,-23.24,;14.98,-20.94,;16.3,-21.72,;17.65,-20.97,;18.98,-21.75,;17.67,-19.42,;19.01,-18.67,;16.33,-18.63,;16.35,-17.09,;17.69,-16.33,;17.7,-14.79,;19.04,-14.04,;20.36,-14.82,;21.7,-14.07,;21.71,-12.52,;20.38,-11.74,;19.04,-12.51,;14.99,-19.4,;13.66,-18.62,;13.67,-17.08,;12.32,-19.39,;10.99,-18.62,;10.99,-23.24,;12.33,-24.01,;9.65,-24.01,;9.65,-25.55,;8.32,-23.24,;6.97,-24.01,;6.97,-25.55,;5.63,-26.32,;5.63,-27.86,;4.3,-28.63,;2.97,-27.85,;1.63,-28.62,;1.63,-30.16,;2.97,-30.93,;4.3,-30.16,;5.64,-23.24,;4.3,-24.01,)|
BDBM50330256 Oc1cc2c(O)c(-c3c(O)c4cc(O)c(O)c(=Cc5ccc(Cl)cc5)c4c(O)c3=C)c(=C)c(O)c2c(=Cc2ccc(Cl)cc2)c1O |w:36.40,17.17,(13.56,-4.78,;14.89,-5.55,;16.23,-4.77,;17.57,-5.55,;18.9,-4.77,;18.89,-3.23,;20.24,-5.55,;21.58,-4.78,;22.91,-5.55,;22.9,-7.09,;24.23,-4.8,;25.55,-5.58,;26.9,-4.82,;28.22,-5.61,;26.91,-3.28,;28.26,-2.52,;25.58,-2.49,;25.6,-.95,;26.93,-.19,;28.26,-.98,;29.59,-.22,;29.61,1.32,;30.95,2.08,;28.27,2.1,;26.94,1.34,;24.24,-3.25,;22.91,-2.48,;22.92,-.94,;21.57,-3.24,;20.24,-2.47,;20.24,-7.09,;21.58,-7.86,;18.9,-7.86,;18.9,-9.4,;17.57,-7.1,;16.23,-7.87,;16.22,-9.4,;14.89,-10.17,;13.56,-9.4,;12.23,-10.16,;12.23,-11.7,;10.89,-12.47,;13.57,-12.48,;14.9,-11.7,;14.89,-7.1,;13.56,-7.87,)|
BDBM50330257 CC1=C(C(=O)c2cc(O)c(O)c(C(=O)Cc3ccccc3)c2C1=O)C1=C(C)C(=O)c2c(cc(O)c(O)c2C(=O)Cc2ccccc2)C1=O |c:27,t:1|
BDBM50330258 CC(CNC(=O)c1c(O)c(O)cc2C(=O)C(=C(C)C(=O)c12)C1=C(C)C(=O)c2c(cc(O)c(O)c2C(=O)NCC(C)c2ccccc2)C1=O)c1ccccc1 |c:23,t:15|
BDBM50330247 CC(C)=c1c(O)c(O)cc2c(O)c(-c3c(O)c4cc(O)c(O)c(=C(C)C)c4c(O)c3=C)c(=C)c(O)c12 |(3.81,-6.1,;2.48,-6.86,;1.15,-6.08,;2.46,-8.4,;3.8,-9.19,;5.14,-8.43,;3.78,-10.73,;5.1,-11.52,;2.43,-11.49,;1.11,-10.71,;-.21,-11.46,;-.21,-13,;-1.54,-10.69,;-2.88,-11.46,;-4.22,-10.68,;-4.22,-9.14,;-5.55,-11.46,;-6.89,-10.68,;-8.22,-11.46,;-9.55,-10.69,;-8.22,-13.01,;-9.55,-13.78,;-6.89,-13.78,;-6.89,-15.31,;-8.22,-16.08,;-5.56,-16.08,;-5.55,-13.01,;-4.21,-13.77,;-4.21,-15.31,;-2.87,-13,;-1.54,-13.77,;-1.55,-9.16,;-2.88,-8.39,;-.21,-8.39,;-.2,-6.85,;1.13,-9.16,)|
BDBM50330248 CC(C)C=c1c(O)c(O)cc2c(O)c(-c3c(O)c4cc(O)c(O)c(=CC(C)C)c4c(O)c3=C)c(=C)c(O)c12 |w:3.2,24.24,(18.99,-45.93,;18.99,-44.39,;17.66,-43.62,;20.32,-43.62,;20.33,-42.08,;18.99,-41.31,;17.66,-42.08,;18.99,-39.76,;17.66,-39,;20.33,-38.98,;21.67,-39.76,;23,-38.98,;23,-37.44,;24.34,-39.76,;25.68,-38.99,;27.01,-39.77,;27.01,-41.31,;28.33,-39.01,;29.66,-39.79,;31.01,-39.04,;32.33,-39.82,;31.02,-37.49,;32.36,-36.73,;29.69,-36.7,;29.7,-35.16,;31.04,-34.4,;31.05,-32.86,;32.37,-35.18,;28.35,-37.46,;27.01,-36.69,;27.02,-35.15,;25.67,-37.46,;24.34,-36.69,;24.35,-41.31,;25.68,-42.08,;23,-42.08,;23,-43.62,;21.67,-41.31,)|
BDBM50330249 Cc1ccc(CC=c2c(O)c(O)cc3c(O)c(-c4c(O)c5cc(O)c(O)c(=CCc6ccc(C)cc6)c5c(O)c4=C)c(=C)c(O)c23)cc1 |w:27.27,6.5,(2.55,-7.81,;2.53,-9.35,;3.86,-10.13,;3.85,-11.67,;2.51,-12.42,;2.49,-13.96,;1.15,-14.72,;1.14,-16.26,;2.47,-17.05,;3.81,-16.3,;2.46,-18.6,;3.78,-19.38,;1.11,-19.35,;-.21,-18.57,;-1.54,-19.33,;-1.54,-20.87,;-2.87,-18.56,;-4.2,-19.32,;-5.55,-18.54,;-5.55,-17.01,;-6.88,-19.33,;-8.22,-18.55,;-9.56,-19.33,;-10.89,-18.56,;-9.56,-20.87,;-10.89,-21.64,;-8.22,-21.64,;-8.22,-23.18,;-9.56,-23.95,;-9.56,-25.49,;-10.9,-26.25,;-10.9,-27.79,;-9.57,-28.56,;-9.57,-30.1,;-8.23,-27.79,;-8.23,-26.25,;-6.88,-20.87,;-5.54,-21.64,;-5.54,-23.18,;-4.2,-20.87,;-2.87,-21.64,;-2.87,-17.02,;-4.21,-16.25,;-1.53,-16.25,;-1.53,-14.71,;-.2,-17.03,;1.18,-11.65,;1.19,-10.11,)|
BDBM50330250 Oc1cc2c(O)c(-c3c(O)c4cc(O)c(O)c(=Cc5ccccc5)c4c(O)c3=C)c(=C)c(O)c2c(=Cc2ccccc2)c1O |w:35.39,17.17,(-7.42,-40.72,;-6.09,-41.48,;-4.75,-40.7,;-3.41,-41.48,;-2.08,-40.7,;-2.09,-39.16,;-.74,-41.48,;.59,-40.71,;1.93,-41.49,;1.92,-43.03,;3.25,-40.73,;4.57,-41.51,;5.92,-40.76,;7.24,-41.54,;5.93,-39.21,;7.28,-38.45,;4.6,-38.42,;4.61,-36.88,;5.95,-36.12,;7.28,-36.91,;8.61,-36.15,;8.63,-34.61,;7.29,-33.83,;5.96,-34.6,;3.26,-39.18,;1.93,-38.41,;1.94,-36.87,;.59,-39.18,;-.74,-38.41,;-.74,-43.03,;.6,-43.8,;-2.08,-43.8,;-2.08,-45.34,;-3.41,-43.03,;-4.75,-43.8,;-4.76,-45.34,;-6.09,-46.11,;-7.42,-45.33,;-8.75,-46.1,;-8.76,-47.64,;-7.41,-48.41,;-6.08,-47.64,;-6.09,-43.03,;-7.42,-43.8,)|
BDBM50329370 CN(C)CCCC(O)(c1ccccc1)c1ccccc1
BDBM50329372 NCC(O)(c1ccccc1)c1ccc(F)cc1Cl
BDBM50329373 CCc1cccc(c1)-c1ccc(cc1)C(O)=O
BDBM50329374 CCc1ccc(cc1)-c1ccc(cc1)C(O)=O
BDBM50330251 CCc1ccc(CCNC(=O)c2c(O)c(O)cc3C(=O)C(=C(C)C(=O)c23)C2=C(C)C(=O)c3c(cc(O)c(O)c3C(=O)NCCc3ccc(CC)cc3)C2=O)cc1 |c:28,t:20|
BDBM50336576 O=c1nc2c3cccc4c(ccc(c2c1C#N)c34)N1CCSCC1
BDBM50336577 Cc1ccc(Oc2ccc3c4c(C#N)c(=O)nc4c4cccc2c34)cc1
BDBM50336578 O=c1nc2c3cccc4c(Oc5ccc(cc5)-c5ccccc5)ccc(c2c1C#N)c34
BDBM50336579 COc1ccc(Oc2ccc3c4c(C#N)c(=O)nc4c4cccc2c34)cc1
BDBM50336580 CC(C)c1ccc(Oc2ccc3c4c(C#N)c(=O)nc4c4cccc2c34)cc1
BDBM50336585 COc1ccc(Sc2ccc3c4c(C#N)c(=O)nc4c4cccc2c34)cc1
BDBM50336588 CCC(C)(C)c1ccc(Sc2ccc3c4c(C#N)c(=O)nc4c4cccc2c34)cc1
BDBM50336589 Brc1ccc(Sc2ccc3c4c(C#N)c(=O)nc4c4cccc2c34)cc1
BDBM50336590 Nc1ccc(Sc2ccc3c4c(C#N)c(=O)nc4c4cccc2c34)cc1
BDBM50329387 CC(O)(c1ccc(Cl)cc1)c1ccc(Cl)c(CCOc2ccc(cc2)-c2ccc(cc2)C(O)=O)c1
BDBM50329388 OC(=O)c1ccc(cc1)-c1ccc(OCCc2cc(ccc2Cl)C(O)(CCN2CCOCC2)c2ccc(Br)cc2)cc1
BDBM50329389 CC(C)(C)c1ccc(cc1)C(O)(CCN1CCOCC1)c1ccc(Cl)c(CCOc2ccc(cc2)-c2ccc(cc2)C(O)=O)c1
BDBM50329390 CC(C)(C)c1ccc(cc1)C(O)(CCN1CCCC1)c1ccc(Cl)c(CCOc2ccc(cc2)-c2ccc(cc2)C(O)=O)c1
BDBM50329368 CN(C)CCCC(O)(c1ccc(Cl)cc1)c1ccc(Cl)cc1
BDBM50329369 CN(C)CCCC(O)(c1ccccc1)c1ccc(Cl)cc1
BDBM50329371 CN1CCN(CC1)C(c1ccccc1)c1ccc(Cl)cc1
BDBM50329375 CN(C)CCCC(O)(c1ccccc1)c1cccc(OCCc2cccc(c2)-c2ccc(cc2)C(O)=O)c1
BDBM50329376 CN(C)CCCC(O)(c1ccccc1)c1cccc(OCc2cccc(c2)-c2ccc(cc2)C(O)=O)c1
BDBM50329377 CN(C)CCCC(O)(c1ccccc1)c1cccc(OCc2ccc(cc2)-c2ccc(cc2)C(O)=O)c1
BDBM50329378 CN(C)CCCC(O)(c1ccccc1)c1cccc(OCCc2ccc(cc2)-c2ccc(cc2)C(O)=O)c1
BDBM50329379 CN(C)CCCC(O)(c1ccccc1)c1cccc(CCOc2ccc(cc2)-c2ccc(cc2)C(O)=O)c1
BDBM50329380 CN(C)CCCC(O)(c1ccccc1)c1cccc(OCCOc2ccc(cc2)-c2ccc(cc2)C(O)=O)c1
BDBM50329381 CN(C)CCCC(O)(c1ccccc1)c1ccc(OCc2cccc(c2)-c2ccc(cc2)C(O)=O)cc1
BDBM50329382 CN(C)CCCC(O)(c1ccccc1)c1ccc(OCCc2cccc(c2)-c2ccc(cc2)C(O)=O)cc1
BDBM50329383 CN(C)CCCC(O)(c1ccccc1)c1ccc(OCc2ccc(cc2)-c2ccc(cc2)C(O)=O)cc1
BDBM50329384 CN(C)CCCC(O)(c1ccccc1)c1ccc(OCCc2ccc(cc2)-c2ccc(cc2)C(O)=O)cc1
BDBM50329385 CN(C)CCCC(O)(c1ccccc1)c1ccc(OCCOc2ccc(cc2)-c2ccc(cc2)C(O)=O)cc1
BDBM50329386 OC(=O)c1ccc(cc1)-c1ccc(OCCc2cc(ccc2Cl)C(O)(CCN2CCOCC2)c2ccc(Cl)cc2)cc1
BDBM50351805 COc1ccccc1Oc1ccc2c3c(C#N)c(=O)nc3c3cccc1c23
BDBM50351806 Cc1ccccc1Oc1ccc2c3c(C#N)c(=O)nc3c3cccc1c23
BDBM50351807 Cc1cccc(Oc2ccc3c4c(C#N)c(=O)nc4c4cccc2c34)c1
BDBM50351808 COc1cccc(Oc2ccc3c4c(C#N)c(=O)nc4c4cccc2c34)c1
BDBM50351809 CCC(C)c1ccc(Oc2ccc3c4c(C#N)c(=O)nc4c4cccc2c34)cc1
BDBM161498 CN1C(CC(C(=O)N(c2ccccc2)c2ccc(O)cc2)=C1C)c1cc(Cl)ccc1C(=O)N1Cc2ccccc2C[C@H]1COCCN1CCOCC1 |c:22|
BDBM60607 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(NCC45CC6CC(C[C@@](O)(C6)C4)C5)c(c3)[N+]([O-])=O)c(Oc3ccc4[nH]ccc4c3)c2)=C(C1)c1ccc(Cl)cc1 |r,c:64,TLB:28:29:32:37.34.35,36:35:32:30.39.29,THB:38:29:32:37.34.35,38:35:32:30.39.29|
BDBM161499 C[C@@H]1Cc2ccccc2CN1C(=O)c1cc2OCOc2cc1-c1cc(C(=O)N(c2cnn(C)c2)c2ccc(O)cc2)c(C)n1CCN
BDBM161500 COc1ccc(C(=O)N2Cc3ccccc3C[C@H]2C)c(c1)-c1cc(C(=O)N(c2cnn(C)c2)c2ccc(O)cc2)c(C)n1C
BDBM161501 C[C@@H]1Cc2ccccc2CN1C(=O)c1cc(CNC(=O)Oc2ccccc2)ccc1-c1cc(C(=O)N(C)c2ccc(O)cc2)c(C)n1C
BDBM161502 Cc1c(cc(-c2cc(Cl)ccc2C(=O)N2Cc3ccccc3C[C@H]2CN2CCOCC2)n1C)C(=O)N(c1ccc(O)cc1)c1ccc(F)cc1
BDBM161503 Cc1c(cc(-c2cc(Cl)ccc2C(=O)N2Cc3ccccc3C[C@H]2CN2CCOCC2)n1C)C(=O)N(c1ccc(O)cc1)c1cccc(F)c1
BDBM50362141 COc1ccc(cc1)C(=O)Nc1ccc(cc1)C(=O)NS(=O)(=O)c1ccc(NCCSc2ccccc2)c(c1)[N+]([O-])=O
BDBM50362142 [O-][N+](=O)c1cc(ccc1NCCSc1ccccc1)S(=O)(=O)NC(=O)c1ccc(NS(=O)(=O)c2ccccc2)cc1
BDBM50362143 CC(C)C[C@H](NC(C)=O)C(=O)Nc1ccc(cc1)C(=O)NS(=O)(=O)c1ccc(NCCSc2ccccc2)c(c1)[N+]([O-])=O |r|
BDBM50362144 CC[C@H](C)[C@H](NC(C)=O)C(=O)Nc1ccc(cc1)C(=O)NS(=O)(=O)c1ccc(NCCSc2ccccc2)c(c1)[N+]([O-])=O |r|
BDBM50362145 CSCC[C@H](NC(C)=O)C(=O)Nc1ccc(cc1)C(=O)NS(=O)(=O)c1ccc(NCCSc2ccccc2)c(c1)[N+]([O-])=O |r|
BDBM50362146 CC(=O)N[C@@H](Cc1ccccc1)C(=O)Nc1ccc(cc1)C(=O)NS(=O)(=O)c1ccc(NCCSc2ccccc2)c(c1)[N+]([O-])=O |r|
BDBM50362147 CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)Nc1ccc(cc1)C(=O)NS(=O)(=O)c1ccc(NCCSc2ccccc2)c(c1)[N+]([O-])=O |r|
BDBM50362148 CC(C)[C@H](NC(C)=O)C(=O)Nc1ccc(cc1)C(=O)NS(=O)(=O)c1ccc(NCCSc2ccccc2)c(c1)[N+]([O-])=O |r|
BDBM50362149 [O-][N+](=O)c1cc(ccc1NCCSc1ccccc1)S(=O)(=O)NC(=O)c1ccc(NC(=O)c2ccccc2)cc1
BDBM50362150 [O-][N+](=O)c1cc(ccc1NCCSc1ccccc1)S(=O)(=O)NC(=O)c1ccc(NC(=O)c2ccccc2F)cc1
BDBM50362151 [O-][N+](=O)c1cc(ccc1NCCSc1ccccc1)S(=O)(=O)NC(=O)c1ccc(NC(=O)c2cccc(F)c2)cc1
BDBM50362152 [O-][N+](=O)c1cc(ccc1NCCSc1ccccc1)S(=O)(=O)NC(=O)c1ccc(NC(=O)c2ccc(F)cc2)cc1
BDBM50362153 [O-][N+](=O)c1cc(ccc1NCCSc1ccccc1)S(=O)(=O)NC(=O)c1ccc(NC(=O)c2ccc(Br)cc2)cc1
BDBM161505 CCNC(=O)NCc1ccc(-c2cc(C(=O)N(C)c3ccc(O)cc3)c(C)n2C)c(c1)C(=O)N1Cc2ccccc2C[C@H]1C
BDBM161504 C[C@@H]1Cc2ccccc2CN1C(=O)c1cc(CNC(=O)COc2ccccc2)ccc1-c1cc(C(=O)N(C)c2ccc(O)cc2)c(C)n1C
BDBM50372177 OC(=O)[C@H](Cc1ccccc1)N1C(=S)S\C(=C/c2ccc(OCCOc3ccc(\C=C4/SC(=S)N([C@@H](Cc5ccccc5)C(O)=O)C4=O)cc3)cc2)C1=O
BDBM50372178 OC(=O)[C@H](Cc1ccccc1)N1C(=S)S\C(=C/c2ccc(OCOc3ccc(\C=C4/SC(=S)N([C@@H](Cc5ccccc5)C(O)=O)C4=O)cc3)cc2)C1=O
BDBM50372179 Brc1ccc(\C=C2/SC(=S)N([C@@H](Cc3ccccc3)C(=O)OCCOCCOC(=O)[C@H](Cc3ccccc3)N3C(=S)S\C(=C/c4ccc(Br)cc4)C3=O)C2=O)cc1
BDBM50372180 OC(=O)[C@H](Cc1ccccc1)N1C(=S)S\C(=C/c2ccc(OCCOCCOc3ccc(\C=C4/SC(=S)N([C@@H](Cc5ccccc5)C(O)=O)C4=O)cc3)cc2)C1=O
BDBM50372172 CCOC(=O)[C@H](Cc1ccccc1)N1C(=S)S\C(=C/c2ccc(Br)cc2)C1=O
BDBM50372173 CCOC(=O)[C@H](Cc1ccccc1)N1C(=S)S\C(=C/c2ccc(OCOc3ccc(\C=C4/SC(=S)N([C@@H](Cc5ccccc5)C(=O)OCC)C4=O)cc3)cc2)C1=O
BDBM50372174 Brc1ccc(\C=C2/SC(=S)N([C@@H](Cc3ccccc3)C(=O)OCCOCCOCCOC(=O)[C@H](Cc3ccccc3)N3C(=S)S\C(=C/c4ccc(Br)cc4)C3=O)C2=O)cc1
BDBM50372175 Brc1ccc(\C=C2/SC(=S)N([C@@H](Cc3ccccc3)C(=O)OCCOC(=O)[C@H](Cc3ccccc3)N3C(=S)S\C(=C/c4ccc(Br)cc4)C3=O)C2=O)cc1
BDBM50371611 Oc1c(O)c(cc(C(=O)c2ccc(Oc3ccccc3)cc2)c1O)C(=O)c1nc2ccccc2s1
BDBM50371612 Oc1c(O)c(cc(C(=O)c2cccc3ccccc23)c1O)C(=O)c1ccc(Oc2ccccc2)cc1
BDBM50371613 CC(C)C(=O)c1cc(C(=O)c2ccc(Oc3ccccc3)cc2)c(O)c(O)c1O
BDBM161507 Cc1c(cc(-c2cc(Cl)ccc2C(=O)N2Cc3ccccc3C[C@H]2CO)n1C)C(=O)N(c1ccccc1)c1ccc(O)cc1
BDBM161506 C[C@@H]1Cc2ccccc2CN1C(=O)c1cc(CNC(=O)NCc2ccccc2)ccc1-c1cc(C(=O)N(C)c2ccc(O)cc2)c(C)n1C
BDBM50371615 CC(C)c1cc(C(=O)c2ccc(Oc3ccccc3)cc2)c(O)c(O)c1O
BDBM50372176 OC(=O)[C@H](Cc1ccccc1)N1C(=S)S\C(=C/c2ccc(OCCOCCOCCOc3ccc(\C=C4/SC(=S)N([C@@H](Cc5ccccc5)C(O)=O)C4=O)cc3)cc2)C1=O
BDBM50371614 CC(C)c1cc(C(=O)c2ccccc2)c(O)c(O)c1O
BDBM161508 C[C@@H]1Cc2ccccc2CN1C(=O)c1cc2OCOc2cc1-c1cc(C(=O)N(c2cnn(C)c2)c2ccc(O)cc2)c(C)n1C
BDBM161509 C[C@@H]1Cc2ccccc2CN1C(=O)c1ccc(CNC(=O)Oc2ccccc2)cc1-c1cc(C(=O)N(C)c2ccc(O)cc2)c(C)n1C
BDBM161510 C[C@@H]1Cc2ccccc2CN1C(=O)c1cc2OCOc2cc1-c1cc(C(=O)N(c2ccc(O)cc2)c2cccc(F)c2)c(C)n1C
BDBM50376902 COC1=CC(=N\C1=C/c1[nH]c(C)cc1C)c1cc2ccccc2[nH]1 |c:4,t:2|
BDBM161511 C[C@@H]1Cc2ccccc2CN1C(=O)c1cc2OCOc2cc1-c1cc(C(=O)N(c2ccc(O)cc2)c2cnc3n(C)ccc3c2)c(C)n1C
BDBM50384309 CCOC(=O)c1nn(c(C)c1-c1ccc(cc1C(=O)N1CCc2ccccc2C1)C(=O)NS(=O)(=O)c1ccc2ccccc2c1)-c1ccccc1 |(-8.18,2.42,;-6.72,1.95,;-6.4,.44,;-4.94,-.04,;-3.79,.99,;-4.62,-1.54,;-5.65,-2.68,;-4.88,-4.02,;-3.37,-3.7,;-3.42,-5.25,;-3.21,-2.17,;-1.87,-1.4,;-1.87,.14,;-.53,.91,;.8,.13,;.8,-1.41,;-.55,-2.17,;-.55,-3.71,;-1.89,-4.48,;.78,-4.49,;.77,-6.02,;2.1,-6.8,;3.43,-6.04,;4.75,-6.82,;6.09,-6.06,;6.11,-4.52,;4.78,-3.74,;3.45,-4.5,;2.12,-3.71,;2.14,.9,;2.15,2.44,;3.47,.12,;4.8,.89,;4.02,2.22,;5.56,2.23,;6.14,.11,;6.12,-1.43,;7.46,-2.21,;8.81,-1.43,;10.15,-2.19,;11.48,-1.41,;11.46,.14,;10.12,.9,;8.8,.11,;7.47,.88,;-5.6,-5.37,;-7.14,-5.42,;-7.87,-6.78,;-7.06,-8.09,;-5.51,-8.03,;-4.79,-6.68,)|
BDBM50384310 CCCCc1c(c(nn1-c1ccccc1)C(=O)OCC)-c1ccc(cc1C(=O)N1CCc2ccccc2C1)C(=O)NS(=O)(=O)c1ccc2ccccc2c1 |(24.15,-7.18,;22.84,-6.37,;22.88,-4.84,;21.57,-4.03,;21.62,-2.48,;21.78,-.95,;20.37,-.32,;19.34,-1.46,;20.11,-2.8,;19.39,-4.15,;17.84,-4.2,;17.12,-5.56,;17.93,-6.87,;19.48,-6.81,;20.2,-5.46,;20.05,1.19,;21.2,2.22,;18.59,1.66,;18.27,3.17,;16.81,3.65,;23.12,-.18,;23.12,1.36,;24.46,2.13,;25.79,1.36,;25.79,-.19,;24.44,-.95,;24.44,-2.49,;23.1,-3.25,;25.77,-3.27,;25.76,-4.8,;27.09,-5.58,;28.42,-4.82,;29.74,-5.6,;31.08,-4.84,;31.1,-3.3,;29.77,-2.52,;28.44,-3.28,;27.11,-2.49,;27.13,2.12,;27.14,3.66,;28.46,1.34,;29.79,2.11,;29.01,3.44,;30.55,3.45,;31.13,1.33,;31.11,-.21,;32.45,-.99,;33.8,-.21,;35.14,-.97,;36.47,-.19,;36.46,1.36,;35.11,2.12,;33.79,1.33,;32.46,2.1,)|
BDBM50384311 CCCCc1c(c(nn1-c1ccccc1)C(O)=O)-c1ccc(cc1C(=O)N1CCc2ccccc2C1)C(=O)NS(=O)(=O)c1ccc2ccccc2c1 |(47.07,-6.48,;45.76,-5.67,;45.8,-4.14,;44.49,-3.33,;44.54,-1.78,;44.7,-.25,;43.29,.38,;42.26,-.76,;43.03,-2.1,;42.31,-3.45,;40.77,-3.5,;40.04,-4.86,;40.85,-6.17,;42.4,-6.11,;43.12,-4.76,;42.98,1.89,;41.51,2.36,;44.12,2.92,;46.04,.52,;46.04,2.06,;47.38,2.83,;48.71,2.06,;48.71,.51,;47.36,-.25,;47.36,-1.79,;46.02,-2.55,;48.69,-2.57,;48.69,-4.1,;50.01,-4.88,;51.34,-4.12,;52.66,-4.9,;54.01,-4.14,;54.02,-2.6,;52.69,-1.82,;51.36,-2.58,;50.03,-1.79,;50.05,2.82,;50.06,4.36,;51.38,2.04,;52.71,2.81,;51.93,4.14,;53.47,4.15,;54.05,2.03,;54.04,.49,;55.37,-.29,;56.72,.49,;58.06,-.27,;59.4,.51,;59.38,2.06,;58.03,2.82,;56.71,2.03,;55.38,2.8,)|
BDBM50384312 CCCCc1c(c(CO)nn1-c1ccccc1)-c1ccc(cc1C(=O)N1CCc2ccccc2C1)C(=O)NS(=O)(=O)c1ccc2ccccc2c1 |(-.21,-22.28,;-1.52,-21.47,;-1.48,-19.93,;-2.79,-19.12,;-2.74,-17.58,;-2.58,-16.04,;-3.99,-15.42,;-4.31,-13.91,;-5.77,-13.43,;-5.02,-16.56,;-4.25,-17.89,;-4.97,-19.25,;-6.52,-19.3,;-7.24,-20.65,;-6.43,-21.96,;-4.88,-21.91,;-4.16,-20.55,;-1.24,-15.27,;-1.24,-13.74,;.1,-12.96,;1.43,-13.74,;1.43,-15.28,;.08,-16.05,;.08,-17.59,;-1.26,-18.35,;1.41,-18.36,;1.4,-19.9,;2.73,-20.67,;4.06,-19.91,;5.38,-20.69,;6.72,-19.94,;6.74,-18.4,;5.41,-17.61,;4.08,-18.37,;2.75,-17.59,;2.77,-12.98,;2.78,-11.44,;4.1,-13.75,;5.43,-12.98,;4.65,-11.66,;6.19,-11.65,;6.77,-13.76,;6.75,-15.3,;8.09,-16.08,;9.44,-15.31,;10.78,-16.07,;12.11,-15.29,;12.1,-13.73,;10.75,-12.98,;9.43,-13.76,;8.1,-12.99,)|
BDBM50384313 CCCCc1c(c(nn1-c1ccc(OC)cc1)C(=O)OCC)-c1ccc(cc1C(=O)N1CCc2ccccc2C1)C(=O)NS(=O)(=O)c1ccc2ccccc2c1 |(24.33,-23.45,;23.02,-22.64,;23.06,-21.1,;21.75,-20.29,;21.8,-18.74,;21.96,-17.21,;20.55,-16.58,;19.52,-17.73,;20.29,-19.06,;19.56,-20.42,;18.02,-20.46,;17.3,-21.82,;18.11,-23.13,;17.39,-24.49,;18.2,-25.79,;19.66,-23.08,;20.38,-21.72,;20.23,-15.08,;21.38,-14.05,;18.77,-14.6,;18.45,-13.09,;16.99,-12.62,;23.29,-16.44,;23.29,-14.9,;24.64,-14.13,;25.97,-14.91,;25.96,-16.45,;24.62,-17.21,;24.62,-18.75,;23.28,-19.52,;25.95,-19.53,;25.94,-21.07,;27.27,-21.84,;28.6,-21.08,;29.92,-21.86,;31.26,-21.11,;31.28,-19.57,;29.95,-18.78,;28.62,-19.54,;27.29,-18.76,;27.31,-14.14,;27.32,-12.6,;28.64,-14.92,;29.97,-14.15,;29.19,-12.83,;30.73,-12.81,;31.31,-14.93,;31.29,-16.47,;32.63,-17.25,;33.98,-16.48,;35.32,-17.24,;36.65,-16.45,;36.64,-14.9,;35.29,-14.15,;33.97,-14.93,;32.64,-14.16,)|
BDBM50384314 CCCCc1c(c(nn1-c1cccc(Oc2ccccc2)c1)C(=O)OCC)-c1ccc(cc1C(=O)N1CCc2ccccc2C1)C(=O)NS(=O)(=O)c1ccc2ccccc2c1 |(49.78,-23.14,;48.47,-22.33,;48.52,-20.79,;47.21,-19.98,;47.25,-18.43,;47.42,-16.9,;46.01,-16.27,;44.98,-17.42,;45.75,-18.75,;45.02,-20.11,;43.48,-20.15,;42.75,-21.51,;43.57,-22.82,;45.11,-22.76,;45.93,-24.06,;45.21,-25.42,;43.67,-25.47,;42.95,-26.83,;43.77,-28.14,;45.32,-28.08,;46.03,-26.72,;45.83,-21.41,;45.69,-14.77,;46.83,-13.74,;44.23,-14.29,;43.91,-12.78,;42.44,-12.31,;48.75,-16.13,;48.75,-14.59,;50.09,-13.82,;51.43,-14.6,;51.42,-16.14,;50.08,-16.9,;50.07,-18.44,;48.74,-19.21,;51.4,-19.22,;51.4,-20.75,;52.72,-21.53,;54.06,-20.77,;55.38,-21.55,;56.72,-20.8,;56.74,-19.26,;55.41,-18.47,;54.07,-19.23,;52.74,-18.45,;52.77,-13.83,;52.77,-12.29,;54.1,-14.61,;55.43,-13.84,;54.65,-12.51,;56.19,-12.5,;56.76,-14.62,;56.75,-16.16,;58.08,-16.94,;59.43,-16.17,;60.78,-16.93,;62.11,-16.14,;62.09,-14.59,;60.75,-13.84,;59.42,-14.62,;58.1,-13.85,)|
BDBM50384315 CCCCc1c(c(nn1-c1ccc(Oc2ccccc2)cc1)C(=O)OCC)-c1ccc(cc1C(=O)N1CCc2ccccc2C1)C(=O)NS(=O)(=O)c1ccc2ccccc2c1 |(-1.21,-39.36,;-2.52,-38.55,;-2.47,-37.01,;-3.78,-36.2,;-3.74,-34.66,;-3.57,-33.12,;-4.98,-32.5,;-6.01,-33.64,;-5.25,-34.98,;-5.97,-36.33,;-7.51,-36.38,;-8.24,-37.73,;-7.43,-39.04,;-8.15,-40.4,;-7.33,-41.71,;-8.06,-43.06,;-7.25,-44.37,;-5.71,-44.32,;-4.99,-42.95,;-5.8,-41.65,;-5.88,-38.99,;-5.16,-37.63,;-5.3,-30.99,;-4.16,-29.96,;-6.77,-30.51,;-7.08,-29.01,;-8.55,-28.53,;-2.24,-32.36,;-2.24,-30.82,;-.9,-30.04,;.44,-30.82,;.43,-32.36,;-.91,-33.13,;-.92,-34.67,;-2.25,-35.43,;.41,-35.44,;.41,-36.98,;1.73,-37.75,;3.07,-36.99,;4.39,-37.77,;5.73,-37.02,;5.74,-35.48,;4.42,-34.69,;3.08,-35.45,;1.75,-34.67,;1.77,-30.06,;1.78,-28.52,;3.1,-30.83,;4.44,-30.07,;3.66,-28.74,;5.2,-28.73,;5.77,-30.85,;5.76,-32.39,;7.09,-33.17,;8.44,-32.39,;9.79,-33.15,;11.12,-32.37,;11.1,-30.81,;9.76,-30.06,;8.43,-30.84,;7.1,-30.07,)|
BDBM50384316 CCCCc1c(c(CO)nn1-c1ccc(Oc2ccccc2)cc1)-c1ccc(cc1C(=O)N1CCc2ccccc2C1)C(=O)NS(=O)(=O)c1ccc2ccccc2c1 |(23.83,-40.71,;22.52,-39.91,;22.56,-38.37,;21.25,-37.56,;21.29,-36.01,;21.46,-34.48,;20.05,-33.85,;19.73,-32.35,;18.27,-31.87,;19.02,-35,;19.79,-36.33,;19.06,-37.69,;17.52,-37.73,;16.8,-39.09,;17.61,-40.4,;16.89,-41.75,;17.7,-43.06,;16.97,-44.42,;17.78,-45.72,;19.32,-45.67,;20.05,-44.3,;19.23,-43,;19.16,-40.34,;19.88,-38.99,;22.79,-33.71,;22.79,-32.17,;24.14,-31.4,;25.47,-32.18,;25.46,-33.72,;24.12,-34.48,;24.12,-36.02,;22.78,-36.79,;25.45,-36.8,;25.44,-38.33,;26.76,-39.11,;28.1,-38.35,;29.42,-39.13,;30.76,-38.38,;30.78,-36.84,;29.45,-36.05,;28.12,-36.81,;26.78,-36.03,;26.81,-31.41,;26.81,-29.87,;28.14,-32.19,;29.47,-31.42,;28.69,-30.09,;30.23,-30.08,;30.8,-32.2,;30.79,-33.74,;32.12,-34.52,;33.47,-33.75,;34.82,-34.51,;36.15,-33.72,;36.13,-32.17,;34.79,-31.42,;33.46,-32.2,;32.14,-31.43,)|
BDBM50384317 CCCCc1c(c(CO)nn1-c1ccc(Oc2ccc(Cl)cc2)cc1)-c1ccc(cc1C(=O)N1CCc2ccccc2C1)C(=O)NS(=O)(=O)c1ccc2ccccc2c1 |(47.67,-42.35,;46.36,-41.54,;46.4,-40,;45.09,-39.19,;45.14,-37.65,;45.3,-36.11,;43.89,-35.49,;43.58,-33.98,;42.11,-33.5,;42.86,-36.63,;43.63,-37.96,;42.91,-39.32,;41.37,-39.37,;40.64,-40.72,;41.45,-42.03,;40.73,-43.39,;41.54,-44.69,;40.81,-46.05,;41.63,-47.36,;43.17,-47.31,;43.98,-48.61,;43.89,-45.94,;43.07,-44.64,;43,-41.98,;43.72,-40.62,;46.64,-35.34,;46.64,-33.81,;47.98,-33.03,;49.31,-33.81,;49.31,-35.35,;47.96,-36.12,;47.96,-37.66,;46.62,-38.42,;49.29,-38.43,;49.28,-39.97,;50.61,-40.74,;51.94,-39.98,;53.26,-40.76,;54.6,-40.01,;54.62,-38.47,;53.29,-37.68,;51.96,-38.44,;50.63,-37.66,;50.65,-33.05,;50.66,-31.51,;51.98,-33.82,;53.31,-33.06,;52.53,-31.73,;54.07,-31.72,;54.65,-33.83,;54.63,-35.38,;55.97,-36.15,;57.32,-35.38,;58.66,-36.14,;59.99,-35.36,;59.98,-33.8,;58.63,-33.05,;57.31,-33.83,;55.98,-33.06,)|
BDBM50384318 CCCCc1c(c(CO)nn1-c1ccc(Oc2cccc(Cl)c2)cc1)-c1ccc(cc1C(=O)N1CCc2ccccc2C1)C(=O)NS(=O)(=O)c1ccc2ccccc2c1 |(-1.41,-6.84,;-2.72,-6.03,;-2.67,-4.49,;-3.99,-3.68,;-3.94,-2.14,;-3.78,-.6,;-5.18,.02,;-5.5,1.53,;-6.97,2,;-6.22,-1.12,;-5.45,-2.46,;-6.17,-3.81,;-7.71,-3.86,;-8.44,-5.21,;-7.63,-6.52,;-8.35,-7.88,;-7.53,-9.19,;-8.27,-10.54,;-7.45,-11.85,;-5.91,-11.8,;-5.19,-10.43,;-3.65,-10.37,;-6,-9.13,;-6.08,-6.47,;-5.36,-5.11,;-2.44,.16,;-2.44,1.7,;-1.1,2.48,;.23,1.7,;.23,.16,;-1.11,-.61,;-1.12,-2.15,;-2.46,-2.91,;.21,-2.92,;.21,-4.46,;1.53,-5.23,;2.86,-4.47,;4.18,-5.25,;5.53,-4.5,;5.54,-2.96,;4.21,-2.17,;2.88,-2.93,;1.55,-2.15,;1.57,2.46,;1.58,4,;2.9,1.69,;4.23,2.45,;3.45,3.78,;4.99,3.79,;5.57,1.67,;5.56,.13,;6.89,-.65,;8.24,.13,;9.58,-.63,;10.92,.15,;10.9,1.71,;9.55,2.46,;8.23,1.68,;6.9,2.45,)|
BDBM50384319 CCCCOc1ccc(cc1)-n1nc(CO)c(c1CCCC)-c1ccc(cc1C(=O)N1CCc2ccccc2C1)C(=O)NS(=O)(=O)c1ccc2ccccc2c1 |(15.14,-13.86,;15.87,-12.5,;15.06,-11.2,;15.78,-9.84,;14.97,-8.53,;15.69,-7.18,;14.88,-5.87,;15.6,-4.51,;17.14,-4.46,;17.95,-5.77,;17.23,-7.12,;17.87,-3.11,;17.1,-1.78,;18.13,-.63,;17.81,.87,;16.35,1.35,;19.54,-1.26,;19.37,-2.79,;19.33,-4.34,;20.64,-5.15,;20.6,-6.68,;21.91,-7.49,;20.87,-.49,;20.87,1.05,;22.22,1.82,;23.55,1.04,;23.54,-.5,;22.2,-1.26,;22.2,-2.8,;20.86,-3.57,;23.53,-3.58,;23.52,-5.11,;24.84,-5.89,;26.18,-5.13,;27.5,-5.91,;28.84,-5.15,;28.86,-3.61,;27.53,-2.83,;26.19,-3.59,;24.86,-2.8,;24.89,1.81,;24.89,3.35,;26.22,1.03,;27.55,1.8,;26.77,3.13,;28.31,3.14,;28.88,1.02,;28.87,-.52,;30.2,-1.3,;31.55,-.52,;32.9,-1.29,;34.23,-.5,;34.21,1.05,;32.87,1.81,;31.54,1.02,;30.22,1.79,)|
BDBM50384320 CCCCc1c(c(CO)nn1-c1ccc(cc1)-c1ccccc1)-c1ccc(cc1C(=O)N1CCc2ccccc2C1)C(=O)NS(=O)(=O)c1ccc2ccccc2c1 |(46.25,-7.57,;44.94,-6.76,;44.98,-5.22,;43.67,-4.42,;43.72,-2.87,;43.88,-1.34,;42.47,-.71,;42.15,.8,;40.69,1.27,;41.44,-1.85,;42.21,-3.19,;41.49,-4.54,;39.95,-4.59,;39.22,-5.94,;40.03,-7.25,;41.58,-7.2,;42.3,-5.84,;39.31,-8.61,;37.77,-8.66,;37.04,-10.02,;37.86,-11.32,;39.4,-11.27,;40.12,-9.91,;45.22,-.57,;45.22,.97,;46.56,1.74,;47.89,.97,;47.89,-.57,;46.54,-1.34,;46.54,-2.88,;45.2,-3.64,;47.87,-3.65,;47.86,-5.19,;49.19,-5.97,;50.52,-5.21,;51.84,-5.98,;53.18,-5.23,;53.2,-3.69,;51.87,-2.9,;50.54,-3.67,;49.21,-2.88,;49.23,1.73,;49.24,3.27,;50.56,.95,;51.89,1.72,;51.11,3.05,;52.65,3.06,;53.23,.94,;53.21,-.6,;54.55,-1.38,;55.9,-.6,;57.24,-1.36,;58.57,-.58,;58.56,.97,;57.21,1.73,;55.89,.94,;54.56,1.72,)|
BDBM50384321 CCCCc1c(c(CO)nn1-c1ccc(CCO)cc1)-c1ccc(cc1C(=O)N1CCc2ccccc2C1)C(=O)NS(=O)(=O)c1ccc2ccccc2c1 |(-.54,-26.2,;-1.85,-25.39,;-1.8,-23.85,;-3.11,-23.04,;-3.07,-21.5,;-2.91,-19.96,;-4.31,-19.34,;-4.63,-17.83,;-6.1,-17.35,;-5.34,-20.48,;-4.58,-21.81,;-5.3,-23.17,;-6.84,-23.22,;-7.57,-24.57,;-6.76,-25.88,;-7.48,-27.24,;-9.02,-27.29,;-9.75,-28.65,;-5.21,-25.83,;-4.49,-24.47,;-1.57,-19.19,;-1.57,-17.66,;-.23,-16.88,;1.11,-17.66,;1.1,-19.2,;-.24,-19.97,;-.25,-21.51,;-1.59,-22.27,;1.08,-22.28,;1.08,-23.82,;2.4,-24.59,;3.74,-23.83,;5.06,-24.61,;6.4,-23.86,;6.41,-22.32,;5.08,-21.53,;3.75,-22.29,;2.42,-21.51,;2.44,-16.9,;2.45,-15.36,;3.77,-17.67,;5.1,-16.9,;4.32,-15.58,;5.86,-15.57,;6.44,-17.68,;6.43,-19.22,;7.76,-20,;9.11,-19.23,;10.45,-19.99,;11.79,-19.21,;11.77,-17.65,;10.42,-16.9,;9.1,-17.68,;7.77,-16.91,)|
BDBM50384322 CCCCc1c(c(CO)nn1-c1ccc(CCCO)cc1)-c1ccc(cc1C(=O)N1CCc2ccccc2C1)C(=O)NS(=O)(=O)c1ccc2ccccc2c1 |(23.77,-26.25,;22.46,-25.44,;22.51,-23.9,;21.2,-23.1,;21.24,-21.55,;21.4,-20.02,;20,-19.39,;19.68,-17.88,;18.21,-17.41,;18.97,-20.53,;19.73,-21.87,;19.01,-23.22,;17.47,-23.27,;16.74,-24.62,;17.55,-25.93,;16.83,-27.29,;15.29,-27.34,;14.57,-28.7,;13.03,-28.75,;19.1,-25.88,;19.82,-24.52,;22.74,-19.25,;22.74,-17.71,;24.08,-16.94,;25.42,-17.71,;25.41,-19.25,;24.07,-20.02,;24.06,-21.56,;22.72,-22.32,;25.39,-22.33,;25.39,-23.87,;26.71,-24.65,;28.05,-23.89,;29.37,-24.66,;30.71,-23.91,;30.72,-22.37,;29.39,-21.58,;28.06,-22.35,;26.73,-21.56,;26.75,-16.95,;26.76,-15.41,;28.08,-17.73,;29.41,-16.96,;28.63,-15.63,;30.17,-15.62,;30.75,-17.74,;30.74,-19.28,;32.07,-20.06,;33.42,-19.28,;34.76,-20.04,;36.1,-19.26,;36.08,-17.71,;34.73,-16.95,;33.41,-17.74,;32.08,-16.96,)|
BDBM50384323 CCCCc1c(c(CO)nn1-c1cccc(CO)c1)-c1ccc(cc1C(=O)N1CCc2ccccc2C1)C(=O)NS(=O)(=O)c1ccc2ccccc2c1 |(48.56,-26.2,;47.25,-25.39,;47.3,-23.85,;45.99,-23.04,;46.03,-21.5,;46.2,-19.96,;44.79,-19.34,;44.47,-17.83,;43,-17.35,;43.76,-20.48,;44.52,-21.82,;43.8,-23.17,;42.26,-23.22,;41.53,-24.57,;42.34,-25.88,;43.89,-25.83,;44.71,-27.13,;43.99,-28.49,;44.61,-24.47,;47.53,-19.2,;47.53,-17.66,;48.87,-16.88,;50.21,-17.66,;50.2,-19.2,;48.86,-19.97,;48.85,-21.51,;47.52,-22.27,;50.18,-22.28,;50.18,-23.82,;51.5,-24.59,;52.84,-23.83,;54.16,-24.61,;55.5,-23.86,;55.51,-22.32,;54.19,-21.53,;52.85,-22.29,;51.52,-21.51,;51.54,-16.9,;51.55,-15.36,;52.87,-17.67,;54.21,-16.91,;53.43,-15.58,;54.97,-15.57,;55.54,-17.69,;55.53,-19.23,;56.86,-20.01,;58.21,-19.23,;59.56,-19.99,;60.89,-19.21,;60.87,-17.65,;59.53,-16.9,;58.2,-17.68,;56.87,-16.91,)|
BDBM50384324 CCCCc1c(c(CO)nn1-c1ccccc1)-c1ccc(cc1C(=O)N1Cc2ccccc2C[C@H]1CO)C(=O)NS(=O)(=O)c1ccc2ccccc2c1 |r,wU:34.39,(-8.12,-38.1,;-6.89,-39.03,;-5.47,-38.44,;-5.28,-36.91,;-3.85,-36.31,;-2.39,-35.82,;-2.4,-34.28,;-1.16,-33.36,;-1.34,-31.83,;-3.87,-33.82,;-4.77,-35.07,;-6.3,-34.97,;-6.98,-33.59,;-8.52,-33.49,;-9.37,-34.77,;-8.68,-36.16,;-7.15,-36.25,;-1.14,-36.72,;.21,-35.98,;1.54,-36.79,;1.49,-38.33,;.14,-39.06,;-1.18,-38.25,;-2.53,-38.98,;-3.84,-38.18,;-2.57,-40.52,;-1.26,-41.33,;-1.31,-42.87,;0,-43.68,;-.05,-45.22,;-1.41,-45.94,;-2.72,-45.13,;-2.67,-43.6,;-3.97,-42.79,;-3.93,-41.25,;-5.24,-40.45,;-6.59,-41.18,;2.8,-39.14,;4.16,-38.41,;2.76,-40.68,;4.07,-41.48,;4.86,-40.16,;5.61,-41.5,;4.03,-43.02,;2.67,-43.75,;2.62,-45.29,;3.95,-46.11,;3.93,-47.65,;5.25,-48.45,;6.61,-47.69,;6.63,-46.14,;5.3,-45.36,;5.34,-43.82,)|
BDBM50384325 CCCCc1c(c(CO)nn1-c1ccccc1)-c1ccc(cc1C(=O)N1Cc2ccccc2C[C@H]1CN)C(=O)NS(=O)(=O)c1ccc2ccccc2c1 |r,wU:34.39,(11.77,-38.55,;13.06,-39.38,;14.43,-38.69,;14.52,-37.15,;15.9,-36.45,;17.32,-35.86,;17.2,-34.32,;18.37,-33.32,;18.08,-31.81,;15.7,-33.96,;14.89,-35.28,;13.36,-35.29,;12.58,-33.96,;11.04,-33.97,;10.28,-35.31,;11.07,-36.64,;12.6,-36.63,;18.63,-36.66,;19.98,-35.92,;21.31,-36.73,;21.26,-38.28,;19.91,-39.01,;18.59,-38.2,;17.24,-38.93,;15.93,-38.12,;17.2,-40.47,;18.51,-41.27,;18.46,-42.82,;19.77,-43.62,;19.72,-45.16,;18.36,-45.89,;17.05,-45.07,;17.1,-43.54,;15.8,-42.73,;15.84,-41.2,;14.53,-40.39,;13.18,-41.12,;22.57,-39.08,;23.93,-38.35,;22.53,-40.62,;23.84,-41.42,;24.63,-40.1,;25.38,-41.45,;23.8,-42.97,;22.44,-43.7,;22.39,-45.24,;23.72,-46.05,;23.7,-47.6,;25.02,-48.39,;26.38,-47.63,;26.39,-46.09,;25.07,-45.3,;25.11,-43.77,)|
BDBM50384326 CCCCc1c(c(CO)nn1-c1ccccc1)-c1ccc(cc1C(=O)N1CCc2ccccc2C1)C(=O)NS(=O)(=O)CC[Si](C)(C)C |(33.41,-39.78,;34.7,-40.62,;36.07,-39.92,;36.15,-38.39,;37.53,-37.68,;38.96,-37.09,;38.83,-35.56,;40,-34.56,;39.72,-33.04,;37.33,-35.2,;36.53,-36.51,;35,-36.53,;34.22,-35.2,;32.68,-35.21,;31.92,-36.55,;32.71,-37.88,;34.24,-37.86,;40.27,-37.9,;41.62,-37.16,;42.94,-37.97,;42.9,-39.51,;41.54,-40.24,;40.23,-39.43,;38.87,-40.17,;37.56,-39.36,;38.83,-41.71,;37.48,-42.44,;37.43,-43.97,;38.74,-44.78,;38.69,-46.31,;39.99,-47.13,;41.35,-46.4,;41.41,-44.86,;40.1,-44.05,;40.15,-42.51,;44.21,-40.32,;45.57,-39.59,;44.17,-41.86,;45.48,-42.66,;46.27,-41.34,;47.02,-42.69,;45.43,-44.21,;46.75,-45.01,;46.72,-46.55,;48.03,-47.35,;45.37,-47.29,;46.7,-48.08,)|
BDBM50384327 CCCCc1c(c(CO)nn1-c1ccc(Oc2cccc(Cl)c2)cc1)-c1ccc(cc1C(=O)N1CCc2ccccc2C1)C(=O)NS(=O)(=O)CC |(-5.26,-3.34,;-3.97,-4.18,;-2.6,-3.48,;-2.52,-1.94,;-1.14,-1.24,;.29,-.65,;.16,.88,;1.33,1.89,;1.05,3.4,;-1.33,1.24,;-2.14,-.07,;-3.67,-.08,;-4.45,1.25,;-5.99,1.23,;-6.75,-.11,;-8.29,-.12,;-9.07,1.21,;-10.61,1.18,;-11.4,2.5,;-10.64,3.85,;-9.1,3.87,;-8.34,5.21,;-8.32,2.54,;-5.96,-1.44,;-4.43,-1.42,;1.6,-1.45,;2.95,-.72,;4.28,-1.53,;4.23,-3.07,;2.88,-3.8,;1.56,-2.99,;.21,-3.72,;-1.1,-2.91,;.16,-5.26,;-1.19,-5.99,;-1.23,-7.53,;.07,-8.34,;.02,-9.87,;1.32,-10.68,;2.68,-9.96,;2.74,-8.42,;1.43,-7.61,;1.48,-6.07,;5.54,-3.88,;6.9,-3.15,;5.5,-5.42,;6.81,-6.22,;7.6,-4.9,;8.35,-6.24,;6.77,-7.76,;8.08,-8.56,)|
BDBM50384328 CCCCCS(=O)(=O)NC(=O)c1ccc(-c2c(CO)nn(c2CCCC)-c2ccc(Oc3cccc(Cl)c3)cc2)c(c1)C(=O)N1CCc2ccccc2C1 |(32.41,-13.03,;32.45,-11.49,;31.13,-10.69,;31.17,-9.15,;29.85,-8.35,;29.89,-6.8,;30.69,-5.48,;31.43,-6.83,;28.58,-6,;28.63,-4.46,;29.98,-3.73,;27.32,-3.65,;27.36,-2.11,;26.04,-1.3,;24.69,-2.04,;23.37,-1.23,;23.25,.3,;24.42,1.3,;24.14,2.82,;21.75,.66,;20.95,-.65,;21.95,-1.82,;20.57,-2.53,;20.49,-4.06,;19.11,-4.76,;17.82,-3.92,;19.41,-.67,;18.63,.66,;17.09,.65,;16.33,-.69,;14.79,-.7,;14.01,.62,;12.47,.6,;11.7,1.92,;12.44,3.27,;13.98,3.28,;14.74,4.63,;14.76,1.96,;17.12,-2.02,;18.66,-2,;24.65,-3.57,;25.96,-4.38,;23.29,-4.31,;21.98,-3.5,;23.25,-5.84,;21.9,-6.58,;21.85,-8.11,;23.16,-8.92,;23.11,-10.45,;24.41,-11.27,;25.77,-10.54,;25.82,-9,;24.52,-8.19,;24.57,-6.65,)|
BDBM50384329 CCCCc1c(c(CO)nn1-c1ccc(Oc2cccc(Cl)c2)cc1)-c1ccc(cc1C(=O)N1CCc2ccccc2C1)C(=O)NS(=O)(=O)c1ccc2cccc(Cl)c2c1 |(-.35,-2.86,;.94,-3.7,;2.31,-3,;2.4,-1.46,;3.78,-.76,;5.2,-.17,;5.07,1.37,;6.24,2.37,;5.96,3.88,;3.58,1.72,;2.77,.41,;1.24,.4,;.46,1.73,;-1.08,1.72,;-1.84,.38,;-3.38,.36,;-4.16,1.69,;-5.7,1.67,;-6.48,2.99,;-5.73,4.34,;-4.19,4.35,;-3.43,5.69,;-3.41,3.02,;-1.05,-.96,;.48,-.94,;6.51,-.97,;7.86,-.24,;9.19,-1.04,;9.14,-2.59,;7.79,-3.32,;6.47,-2.51,;5.12,-3.24,;3.81,-2.43,;5.07,-4.78,;3.72,-5.51,;3.68,-7.04,;4.98,-7.85,;4.93,-9.38,;6.24,-10.2,;7.59,-9.48,;7.65,-7.93,;6.34,-7.13,;6.39,-5.58,;10.45,-3.39,;11.81,-2.66,;10.41,-4.93,;11.73,-5.75,;10.95,-7.08,;12.49,-7.08,;13.07,-4.99,;13.1,-3.45,;14.44,-2.69,;15.76,-3.47,;17.11,-2.71,;18.44,-3.49,;18.43,-5.05,;17.08,-5.81,;17.06,-7.35,;15.75,-5.02,;14.4,-5.78,)|
BDBM50384330 CCCCN(CCCC)c1nccc(n1)-c1ccc(cc1C(=O)N1CCc2ccccc2C1)C(=O)NS(=O)(=O)c1ccc2ccccc2c1
BDBM50384331 CCCCN(CCCC)c1nccc(n1)-c1ccc(cc1C(=O)N1CCc2ccccc2C1)C(=O)NS(=O)(=O)c1ccc2cccc(Cl)c2c1
BDBM50384332 CCCCN(CCCC)c1nccc(n1)-c1ccc(cc1C(=O)N1CCc2ccccc2C1)C(=O)NS(=O)(=O)c1ccc2ccc(I)cc2c1
BDBM50384333 CCCCN(CCCC)c1nccc(n1)-c1ccc(cc1C(=O)N1CCc2ccccc2C1)C(=O)NS(=O)(=O)c1ccc2N(Cc3ccc(Cl)c(Cl)c3)CCc2c1
BDBM50384334 CCCCN(CCCC)c1nccc(n1)-c1ccc(cc1C(=O)N1Cc2ccccc2C[C@H]1CN)C(=O)NS(=O)(=O)c1ccc2ccccc2c1 |r|
BDBM50384335 CCCCN(CCCC)c1nccc(n1)-c1ccc(cc1C(=O)N1Cc2ccccc2C[C@H]1CO)C(=O)NS(=O)(=O)c1ccc2cccc(Cl)c2c1 |r|
BDBM50384336 CCCCN(CCCC)c1ncc(Cl)c(n1)-c1ccc(cc1C(=O)N1CCc2ccccc2C1)C(=O)NS(=O)(=O)c1ccc2ccccc2c1
BDBM50384337 CCCCN(CCCC)c1ncc(C)c(n1)-c1ccc(cc1C(=O)N1CCc2ccccc2C1)C(=O)NS(=O)(=O)c1ccc2ccccc2c1
BDBM50384338 CCCN(CCC)c1nccc(n1)-c1ccc(cc1C(=O)N1CCc2ccccc2C1)C(=O)NS(=O)(=O)c1ccc2ccccc2c1
BDBM50384339 CCCN(CCC)c1ncc(Cl)c(n1)-c1ccc(cc1C(=O)N1Cc2ccccc2C[C@H]1CN)C(=O)NS(=O)(=O)c1ccc2cccc(Cl)c2c1 |r|
BDBM50384340 CCCN(CCC)c1ncc(Cl)c(n1)-c1ccc(cc1C(=O)N1Cc2ccccc2C[C@H]1CO)C(=O)NS(=O)(=O)c1ccc2cccc(Cl)c2c1 |r|
BDBM50384341 CCCCN(CCCC)C(=O)c1nn(c(C)c1Cl)-c1ccc(cc1C(=O)N1Cc2ccccc2C[C@H]1CN1CCOCC1)C(=O)NS(=O)(=O)c1ccc2ccccc2c1 |r|
BDBM50384342 Oc1c(Cl)cc(Cl)cc1S(=O)(=O)N(Cc1ccc(F)cc1)Cc1ccc(cc1)C(=O)N(Cc1ccc(F)cc1)Cc1cc(Cl)cc(Cl)c1
BDBM50384343 CCCCN(CCCC)C(=O)c1nn(c(C)c1Cl)-c1ccc(NS(=O)(=O)c2cc(Cl)cc(Cl)c2O)cc1C(=O)N1CCc2ccccc2C1
BDBM50384344 CCCCN(CCCC)C(=O)c1nn(c(C)c1Cl)-c1ccc(cc1C(=O)N1CCc2ccccc2C1)C(=O)NS(=O)(=O)c1ccc2ccccc2c1
BDBM50384345 CCCCN(CCCC)C(=O)c1nn(c(C)c1Cl)-c1ccc(cc1C(=O)N1CCc2ccccc2C1)C(=O)NS(=O)(=O)c1ccc2cccc(c2c1)S(=O)(=O)CC
BDBM50384346 CCCCN(CCCC)C(=O)c1nn(c(C)c1Cl)-c1ccc(cc1C(=O)N1CCc2ccccc2C1)C(=O)NS(=O)(=O)c1ccc2ccc(OCCN3CCOCC3)cc2c1
BDBM50384347 CCCCN(CCCC)C(=O)c1nn(c(C)c1Cl)-c1ccc(cc1C(=O)N1CCc2ccccc2C1)C(=O)NS(=O)(=O)c1ccc2cccc(OCc3ccc(cc3)C(O)=O)c2c1
BDBM50384348 CCCCN(CCCC)C(=O)c1nn(c(C)c1Cl)-c1ccc(cc1C(=O)N1CCc2ccccc2C1)C(=O)NS(=O)(=O)c1ccc2cccc(I)c2c1
BDBM50384349 CCCCN(CCCC)C(=O)c1nn(c(C)c1Cl)-c1ccc(cc1C(=O)N1CCc2ccccc2C1)C(=O)NS(=O)(=O)c1ccc2ccc(I)cc2c1
BDBM50384350 CCCCN(CCCC)C(=O)c1nn(c(C)c1Cl)-c1ccc(cc1C(=O)N1CCc2ccccc2C1)C(=O)NS(=O)(=O)c1ccc2NCCc2c1
BDBM50384351 CCCCN(CCCC)C(=O)c1nn(c(C)c1Cl)-c1ccc(cc1C(=O)N1CCc2ccccc2C1)C(=O)NS(=O)(=O)c1ccc2N(CCc2c1)C(=O)c1ccc(Cl)c(Cl)c1
BDBM50384352 CCCCN(CCCC)C(=O)c1nn(c(C)c1Cl)-c1ccc(cc1C(=O)N1CCc2ccccc2C1)C(=O)NS(=O)(=O)c1ccc2N(CC)CCc2c1
BDBM50384353 CCCCN(CCCC)C(=O)c1nn(c(C)c1Cl)-c1ccc(cc1C(=O)N1CCc2ccccc2C1)C(=O)NS(=O)(=O)c1ccc2N(Cc3ccc(Cl)c(Cl)c3)CCc2c1
BDBM50384354 CCCCN(CCCC)C(=O)c1nn(c(C)c1Cl)-c1ccc(cc1C(=O)N1CCc2ccccc2C1C)C(=O)NS(=O)(=O)c1ccc2ccccc2c1
BDBM50384355 CCCCN(CCCC)C(=O)c1nn(c(C)c1Cl)-c1ccc(cc1C(=O)N1Cc2ccccc2C[C@H]1CO)C(=O)NS(=O)(=O)c1ccc2ccccc2c1 |r|
BDBM50384356 CCCCN(CCCC)C(=O)c1nn(c(C)c1Cl)-c1ccc(cc1C(=O)N1Cc2ccccc2C[C@H]1COCCCOC)C(=O)NS(=O)(=O)c1ccc2ccccc2c1 |r|
BDBM50384357 CCCCN(CCCC)C(=O)c1nn(c(C)c1Cl)-c1ccc(cc1C(=O)N1Cc2ccccc2C[C@H]1COCCN(C)C)C(=O)NS(=O)(=O)c1ccc2ccccc2c1 |r|
BDBM50384358 CCCCN(CCCC)C(=O)c1nn(c(C)c1Cl)-c1ccc(cc1C(=O)N1Cc2ccccc2C[C@H]1CN)C(=O)NS(=O)(=O)c1ccc2ccccc2c1 |r|
BDBM50384359 CCCCN(CCCC)C(=O)c1nn(c(C)c1Cl)-c1ccc(cc1C(=O)N1Cc2ccccc2C[C@H]1CN1CCN(C)CC1)C(=O)NS(=O)(=O)c1ccc2ccccc2c1 |r|
BDBM50384360 CCCCN(CCCC)C(=O)c1nn(c(C)c1Cl)-c1ccc(cc1C(=O)N1Cc2ccccc2C[C@H]1CN1CCCC1)C(=O)NS(=O)(=O)c1ccc2ccccc2c1 |r|
BDBM50384361 CCCCN(CCCC)C(=O)c1nn(c(C)c1Cl)-c1ccc(cc1C(=O)N1COc2ccccc2C1)C(=O)NS(=O)(=O)c1ccc2ccccc2c1
BDBM50384362 CCCCN(CCCC)C(=O)c1nn(c(C)c1Cl)-c1ccc(cc1C(=O)N1CNc2ccccc2C1)C(=O)NS(=O)(=O)c1ccc2ccccc2c1
BDBM50384363 CCCCN(CCCC)C(=O)c1nn(c(C)c1Cl)-c1ccc(cc1C(=O)N1CCc2ccccc2C1)C(=O)NS(=O)(=O)c1ccc2cccc(OCCN3CCOCC3)c2c1
BDBM50388977 CN(C)CC[C@H](CSc1ccccc1)Nc1ccc(cc1[N+]([O-])=O)S(=O)(=O)Nc1ccc(NCCNc2cccc(c2)-c2c(cn(CC[C@H](O)CO)c2C(=O)NCCCN2CCN(C)CC2)-c2ccc(Cl)cc2)cc1 |r|
BDBM50388978 CN(C)CC[C@H](CSc1ccccc1)Nc1ccc(cc1[N+]([O-])=O)S(=O)(=O)Nc1ccccc1 |r|
BDBM50388979 CN(C)CC[C@H](CSc1ccccc1)Nc1ccc(cc1[N+]([O-])=O)S(=O)(=O)Nc1ccc(cc1)N1CCNCC1 |r|
BDBM50388980 CN1CCN(CCCNC(=O)c2c(c(cn2CC[C@H](O)CO)-c2ccc(Cl)cc2)-c2ccccc2)CC1 |r|
BDBM50388981 CN(C)CC[C@H](CSc1ccccc1)Nc1ccc(cc1[N+]([O-])=O)S(N)(=O)=O |r|
BDBM50388982 CN(C)CC[C@H](CSc1ccccc1)Nc1ccc(cc1[N+]([O-])=O)S(=O)(=O)NC(=O)c1ccc(cc1)N1CCN(CC1)c1cccc(c1)-c1c(cn(CC[C@H](O)CO)c1C(=O)NCCCN1CCN(C)CC1)-c1ccc(Cl)cc1 |r|
BDBM50388983 CN(C)CC[C@H](CSc1ccccc1)Nc1ccc(cc1[N+]([O-])=O)S(=O)(=O)Nc1ccc(cc1)N1CCN(CC1)c1cccc(c1)-c1c(cn(CC[C@H](O)CO)c1C(=O)NCCCN1CCN(C)CC1)-c1ccc(Cl)cc1 |r|
BDBM50388984 CN(C)CC[C@H](CSc1ccccc1)Nc1ccc(cc1[N+]([O-])=O)S(=O)(=O)Nc1ccc(cc1)-c1cn(nn1)-c1cccc(c1)-c1c(cn(CC[C@H](O)CO)c1C(=O)NCCCN1CCN(C)CC1)-c1ccc(Cl)cc1 |r|
BDBM50388985 CN(C)CC[C@H](CSc1ccccc1)Nc1ccc(cc1[N+]([O-])=O)S(=O)(=O)NC(=O)c1ccc(cc1)C#Cc1cccc(c1)-c1c(cn(CC[C@H](O)CO)c1C(=O)NCCCN1CCN(C)CC1)-c1ccc(Cl)cc1 |r|
BDBM50388986 CN(C)CC[C@H](CSc1ccccc1)Nc1ccc(cc1[N+]([O-])=O)S(=O)(=O)Nc1ccc(cc1)C#Cc1cccc(c1)-c1c(cn(CC[C@H](O)CO)c1C(=O)NCCCN1CCN(C)CC1)-c1ccc(Cl)cc1 |r|
BDBM50388987 CN(C)CC[C@H](CSc1ccccc1)Nc1ccc(cc1[N+]([O-])=O)S(=O)(=O)Nc1ccc(cc1)N1CCN(CC1)c1ccc(cc1)-c1c(cn(CC[C@H](O)CO)c1C(=O)NCCCN1CCN(C)CC1)-c1ccc(Cl)cc1 |r|
BDBM50388988 CN(C)CC[C@H](CSc1ccccc1)Nc1ccc(cc1[N+]([O-])=O)S(=O)(=O)Nc1ccc(cc1)N1CCN(Cc2ccccc2-c2ccc(Cl)cc2)CC1 |r|
BDBM50388989 CN(C)CC[C@H](CSc1ccccc1)Nc1ccc(cc1[N+]([O-])=O)S(=O)(=O)Nc1ccc(cc1)N1CCN(CC1)c1cccc(c1)-c1c(cn(C)c1C(=O)NCCCN1CCN(C)CC1)-c1ccc(Cl)cc1 |r|
BDBM50388990 CNC(=O)c1c(c(cn1C)-c1ccc(Cl)cc1)-c1cccc(c1)N1CCN(CC1)c1ccc(NS(=O)(=O)c2ccc(N[C@H](CCN(C)C)CSc3ccccc3)c(c2)[N+]([O-])=O)cc1 |r|
BDBM50388991 CN(C)CC[C@H](CSc1ccccc1)Nc1ccc(cc1[N+]([O-])=O)S(=O)(=O)Nc1ccc(cc1)N1CCN(CC1)c1cccc(c1)-c1cn(C)cc1-c1ccc(Cl)cc1 |r|
BDBM50388992 CCOC(=O)c1c(c(cn1C)-c1ccc(Cl)cc1)-c1cccc(c1)N1CCN(CC1)c1ccc(NS(=O)(=O)c2ccc(N[C@H](CCN(C)C)CSc3ccccc3)c(c2)[N+]([O-])=O)cc1 |r|
BDBM50388993 CN(C)CC[C@H](CSc1ccccc1)Nc1ccc(cc1[N+]([O-])=O)S(=O)(=O)Nc1ccc(cc1)N1CCN(CC1)c1cccc(c1)-c1c(cn(C)c1C(O)=O)-c1ccc(Cl)cc1 |r|
BDBM50388994 CCc1c(c(c(C(O)=O)n1C)-c1cccc(c1)N1CCN(CC1)c1ccc(NS(=O)(=O)c2ccc(N[C@H](CCN(C)C)CSc3ccccc3)c(c2)[N+]([O-])=O)cc1)-c1ccc(Cl)cc1 |r|
BDBM50393831 CC(C)n1c(C)c(C(O)=O)c(c1-c1ccc(Cl)cc1)-c1cccc(c1)N1CCN(CC1)c1ccc(NS(=O)(=O)c2ccc(N[C@H](CCN(C)C)CSc3ccccc3)c(c2)[N+]([O-])=O)cc1 |r|
BDBM50393832 CCn1c(C)c(C(O)=O)c(c1-c1ccc(Cl)cc1)-c1cccc(c1)N1CCN(CC1)c1ccc(NS(=O)(=O)c2ccc(N[C@H](CCN(C)C)CSc3ccccc3)c(c2)[N+]([O-])=O)cc1 |r|
BDBM50393833 CN(C)CC[C@H](CSc1ccccc1)Nc1ccc(cc1[N+]([O-])=O)S(=O)(=O)Nc1ccc(cc1)N1CCN(CC1)c1cccc(c1)-c1c(C(O)=O)c(C)n(C)c1-c1ccc(Cl)cc1 |r|
BDBM50393836 CN(C)CC[C@H](CSc1ccccc1)Nc1ccc(cc1[N+]([O-])=O)S(=O)(=O)Nc1ccc(cc1)N1CCN(CC1)c1cccc(c1)-c1cc(C)n(C)c1-c1ccc(Cl)cc1 |r|
BDBM50393837 CNC(=O)c1c(C)n(C)c(c1-c1cccc(c1)N1CCN(CC1)c1ccc(NS(=O)(=O)c2ccc(N[C@H](CCN(C)C)CSc3ccccc3)c(c2)[N+]([O-])=O)cc1)-c1ccc(Cl)cc1 |r|
BDBM50397454 CCCn1c(C)c(C(O)=O)c(c1-c1ccc(Cl)cc1)-c1cccc(c1)N1CCN(CC1)c1ccc(NS(=O)(=O)c2ccc(N[C@H](CCN3CCC(O)CC3)CSc3ccccc3)c(c2)S(=O)(=O)C(F)(F)F)cc1 |r|
BDBM50397455 CC(C)n1c(C)c(C(O)=O)c(c1-c1ccc(Cl)cc1)-c1cccc(c1)N1CCN(CC1)c1ccc(NS(=O)(=O)c2ccc(N[C@H](CCN3CCC(O)CC3)CSc3ccccc3)c(c2)S(=O)(=O)C(F)(F)F)cc1 |r|
BDBM50397453 CCCCn1c(C)c(C(O)=O)c(c1-c1ccc(Cl)cc1)-c1cccc(c1)N1CCN(CC1)c1ccc(NS(=O)(=O)c2ccc(N[C@H](CCN3CCC(O)CC3)CSc3ccccc3)c(c2)S(=O)(=O)C(F)(F)F)cc1 |r|
BDBM50397456 CCn1c(C)c(C(O)=O)c(c1-c1ccc(Cl)cc1)-c1cccc(c1)N1CCN(CC1)c1ccc(NS(=O)(=O)c2ccc(N[C@H](CCN3CCC(O)CC3)CSc3ccccc3)c(c2)S(=O)(=O)C(F)(F)F)cc1 |r|
BDBM50397457 Cc1c(C(O)=O)c(c(-c2ccc(Cl)cc2)n1C)-c1cccc(c1)N1CCN(CC1)c1ccc(NS(=O)(=O)c2ccc(N[C@H](CCN3CCC(C)(O)CC3)CSc3ccccc3)c(c2)S(=O)(=O)C(F)(F)F)cc1 |r|
BDBM50397458 Cc1c(C(O)=O)c(c(-c2ccc(Cl)cc2)n1C)-c1cccc(c1)N1CCN(CC1)c1ccc(NS(=O)(=O)c2ccc(N[C@H](CCN3CCC(O)CC3)CSc3ccccc3)c(c2)S(=O)(=O)C(F)(F)F)cc1 |r|
BDBM50397459 Cc1c(C(O)=O)c(c(-c2ccc(Cl)cc2)n1C)-c1cccc(c1)N1CCN(CC1)c1ccc(NS(=O)(=O)c2ccc(N[C@H](CCN3CC(O)C3)CSc3ccccc3)c(c2)S(=O)(=O)C(F)(F)F)cc1 |r|
BDBM50397460 Cc1c(C(O)=O)c(c(-c2ccc(Cl)cc2)n1C)-c1cccc(c1)N1CCN(CC1)c1ccc(NS(=O)(=O)c2ccc(N[C@H](CCN3CCCCC3)CSc3ccccc3)c(c2)S(=O)(=O)C(F)(F)F)cc1 |r|
BDBM50397461 Cc1c(C(O)=O)c(c(-c2ccc(Cl)cc2)n1C)-c1cccc(c1)N1CCN(CC1)c1ccc(NS(=O)(=O)c2ccc(N[C@H](CCN3CCCC3)CSc3ccccc3)c(c2)S(=O)(=O)C(F)(F)F)cc1 |r|
BDBM50397462 Cc1c(C(O)=O)c(c(-c2ccc(Cl)cc2)n1C)-c1cccc(c1)N1CCN(CC1)c1ccc(NS(=O)(=O)c2ccc(N[C@H](CCN3CCC3)CSc3ccccc3)c(c2)S(=O)(=O)C(F)(F)F)cc1 |r|
BDBM50397463 Cc1c(C(O)=O)c(c(-c2ccc(Cl)cc2)n1C)-c1cccc(c1)N1CCN(CC1)c1ccc(NS(=O)(=O)c2ccc(N[C@H](CCN3CCOCC3)CSc3ccccc3)c(c2)S(=O)(=O)C(F)(F)F)cc1 |r|
BDBM50397464 CN(C)CC[C@H](CSc1ccccc1)Nc1ccc(cc1S(=O)(=O)C(F)(F)F)S(=O)(=O)Nc1ccc(cc1)N1CCN(CC1)c1cccc(c1)-c1c(C(O)=O)c(C)n(C)c1-c1ccc(Cl)cc1 |r|
BDBM50397465 CN1CCN(CCCNC(=O)c2c(C)n(C)c(c2-c2cccc(c2)N2CCN(CC2)c2ccc(NS(=O)(=O)c3cccc(c3)S(=O)(=O)C3CC3)cc2)-c2ccc(Cl)cc2)CC1
BDBM50397466 CCS(=O)(=O)c1cccc(c1)S(=O)(=O)Nc1ccc(cc1)N1CCN(CC1)c1cccc(c1)-c1c(C(=O)NCCCN2CCN(C)CC2)c(C)n(C)c1-c1ccc(Cl)cc1
BDBM50397467 CN1CCN(CCCNC(=O)c2c(C)n(C)c(c2-c2cccc(c2)N2CCN(CC2)c2ccc(NS(=O)(=O)c3cccc(c3)S(C)(=O)=O)cc2)-c2ccc(Cl)cc2)CC1
BDBM50397468 CN1CCN(CCCNC(=O)c2c(C)n(C)c(c2-c2cccc(c2)N2CCN(CC2)c2ccc(NS(=O)(=O)c3cccc(c3)S(=O)(=O)C(F)(F)F)cc2)-c2ccc(Cl)cc2)CC1
BDBM50397469 CC(C)Oc1cccc(c1)S(=O)(=O)Nc1ccc(cc1)N1CCN(CC1)c1cccc(c1)-c1c(C(=O)NCCCN2CCN(C)CC2)c(C)n(C)c1-c1ccc(Cl)cc1
BDBM50397470 CCOc1cccc(c1)S(=O)(=O)Nc1ccc(cc1)N1CCN(CC1)c1cccc(c1)-c1c(C(=O)NCCCN2CCN(C)CC2)c(C)n(C)c1-c1ccc(Cl)cc1
BDBM50397471 COc1cccc(c1)S(=O)(=O)Nc1ccc(cc1)N1CCN(CC1)c1cccc(c1)-c1c(C(=O)NCCCN2CCN(C)CC2)c(C)n(C)c1-c1ccc(Cl)cc1
BDBM50397472 CN1CCN(CCCNC(=O)c2c(C)n(C)c(c2-c2cccc(c2)N2CCN(CC2)c2ccc(NS(=O)(=O)c3cccc(OC(F)(F)F)c3)cc2)-c2ccc(Cl)cc2)CC1
BDBM50397473 CN1CCN(CCCNC(=O)c2c(C)n(C)c(c2-c2cccc(c2)N2CCN(CC2)c2ccc(NS(=O)(=O)c3cccc(c3)C(C)(C)C)cc2)-c2ccc(Cl)cc2)CC1
BDBM50397474 CCc1cccc(c1)S(=O)(=O)Nc1ccc(cc1)N1CCN(CC1)c1cccc(c1)-c1c(C(=O)NCCCN2CCN(C)CC2)c(C)n(C)c1-c1ccc(Cl)cc1
BDBM50397475 CN1CCN(CCCNC(=O)c2c(C)n(C)c(c2-c2cccc(c2)N2CCN(CC2)c2ccc(NS(=O)(=O)c3cccc(C)c3)cc2)-c2ccc(Cl)cc2)CC1
BDBM50397476 CN1CCN(CCCNC(=O)c2c(C)n(C)c(c2-c2cccc(c2)N2CCN(CC2)c2ccc(NS(=O)(=O)c3cccc(c3)C(F)(F)F)cc2)-c2ccc(Cl)cc2)CC1
BDBM50397477 CN1CCN(CCCNC(=O)c2c(C)n(C)c(c2-c2cccc(c2)N2CCN(CC2)c2ccc(NS(=O)(=O)c3cccc(Br)c3)cc2)-c2ccc(Cl)cc2)CC1
BDBM50397478 CN1CCN(CCCNC(=O)c2c(C)n(C)c(c2-c2cccc(c2)N2CCN(CC2)c2ccc(NS(=O)(=O)c3cccc(Cl)c3)cc2)-c2ccc(Cl)cc2)CC1
BDBM50397479 CN1CCN(CCCNC(=O)c2c(C)n(C)c(c2-c2cccc(c2)N2CCN(CC2)c2ccc(NS(=O)(=O)c3cccc(F)c3)cc2)-c2ccc(Cl)cc2)CC1
BDBM50397480 CN1CCN(CCCNC(=O)c2c(C)n(C)c(c2-c2cccc(c2)N2CCN(CC2)c2ccc(NS(=O)(=O)c3ccccc3)cc2)-c2ccc(Cl)cc2)CC1
BDBM50397481 CN1CCN(CCCNC(=O)c2c(C)n(C)c(c2-c2cccc(c2)N2CCN(CC2)c2ccc(NS(=O)(=O)c3cccc(c3)[N+]([O-])=O)cc2)-c2ccc(Cl)cc2)CC1
BDBM50397583 CC(C)c1cc(cc2nc(ccc12)N1CCCC1)-c1cc2ccccc2nc1N1CCCC1
BDBM50397584 CCCOc1nc2ccccc2cc1-c1cc(C(C)C)c2ccc(nc2c1)N1CCOCC1
BDBM50397585 CCCOc1ccc2c(cc(cc2n1)-c1cc2ccccc2nc1N1CCOCC1)C(C)C
BDBM50397586 CCOc1ccc2c(cc(cc2n1)-c1cc2ccccc2nc1N1CCCC1)C(C)C
BDBM50397587 CCOc1ccc2c(cc(cc2n1)-c1cc2ccccc2nc1N1CCOCC1)C(C)C
BDBM50400177 Oc1cc2C(=O)c3ccc(Sc4ccc(Br)cc4)cc3C(=O)c2cc1O
BDBM50400178 Cc1ccc(Sc2ccc3C(=O)c4cc(O)c(O)cc4C(=O)c3c2)cc1
BDBM50400179 Oc1cc2C(=O)c3ccc(Sc4ccccc4)cc3C(=O)c2cc1O
BDBM50400180 CC(C)c1ccc(Sc2ccc3C(=O)c4cc(O)c(O)cc4C(=O)c3c2)cc1
BDBM161512 C[C@@H]1Cc2ccccc2CN1C(=O)c1cc2OCOc2cc1-c1cc(C(=O)N(c2ccccc2)c2ccc(O)cc2)c(C)n1C
BDBM161513 Cc1c(cc(-c2cc3OCOc3cc2C(=O)N2Cc3ccccc3C[C@H]2CN2CCOCC2)n1C)C(=O)N(c1ccc(O)cc1)c1cnc2n(C)ccc2c1
BDBM161514 C[C@@H]1Cc2ccccc2CN1C(=O)c1ccc(CCN(C([O-])=O)c2ccccc2)cc1-c1cc(C(=O)N(C)c2ccc(O)cc2)c(C)n1C
BDBM161515 C[C@@H]1Cc2ccccc2CN1C(=O)c1ccc(CCNC(=O)COc2ccccc2)cc1-c1cc(C(=O)N(C)c2ccc(O)cc2)c(C)n1C
BDBM161516 Cc1c(cc(-c2cc3OCOc3cc2C(=O)N2Cc3ccccc3C[C@H]2CN2CCOCC2)n1C)C(=O)N(c1cnn(C)c1)c1ccc(O)cc1
BDBM161517 COc1ncc(cn1)N(C(=O)c1cc(-c2cc3OCOc3cc2C(=O)N2Cc3ccccc3C[C@H]2C)n(C)c1C)c1ccc(O)cc1
BDBM161518 CN1CCc2cc(cnc12)N(C(=O)c1cc(-c2cc3OCOc3cc2C(=O)N2Cc3ccccc3C[C@H]2CN2CCOCC2)n(C)c1C)c1ccc(O)cc1
BDBM161519 COc1ncc(cn1)N(C(=O)c1cc(-c2cc3OCOc3cc2C(=O)N2Cc3ccccc3C[C@H]2CN2CCOCC2)n(C)c1C)c1ccc(O)cc1
BDBM161520 C[C@@H]1Cc2ccccc2CN1C(=O)c1ccc(CNC(=O)NCc2ccccc2)cc1-c1cc(C(=O)N(C)c2ccc(O)cc2)c(C)n1C
BDBM161521 CCNC(=O)NCc1ccc(C(=O)N2Cc3ccccc3C[C@H]2C)c(c1)-c1cc(C(=O)N(C)c2ccc(O)cc2)c(C)n1C
BDBM161522 C[C@@H]1Cc2ccccc2CN1C(=O)c1ccc(CNC(=O)COc2ccccc2)cc1-c1cc(C(=O)N(C)c2ccc(O)cc2)c(C)n1C
BDBM161523 C[C@@H]1Cc2ccccc2CN1C(=O)c1ccc(CNC(=O)COc2ccccc2)cc1-c1cc(C(=O)N(c2ccc(O)cc2)c2cnc3n(C)ccc3c2)c(C)n1C
BDBM161524 C[C@@H]1Cc2ccccc2CN1C(=O)c1ccc(CCNS(=O)(=O)CCc2ccc(F)cc2)cc1-c1cc(C(=O)N(C)c2ccc(O)cc2)c(C)n1C
BDBM161525 C[C@@H]1Cc2ccccc2CN1C(=O)c1ccc(CCNC(=O)NCc2ccccc2)cc1-c1cc(C(=O)N(C)c2ccc(O)cc2)c(C)n1C
BDBM161526 C[C@@H]1Cc2ccccc2CN1C(=O)c1ccc(CCNC(=O)Cc2ccccc2)cc1-c1cc(C(=O)N(C)c2ccc(O)cc2)c(C)n1C
BDBM161527 C[C@@H]1Cc2ccccc2CN1C(=O)c1ccc(CCNC(=O)Nc2ccccc2)cc1-c1cc(C(=O)N(C)c2ccc(O)cc2)c(C)n1C
BDBM161528 C[C@@H]1Cc2ccccc2CN1C(=O)c1cc(CNS(=O)(=O)CCc2ccc(F)cc2)ccc1-c1cc(C(=O)N(C)c2ccc(O)cc2)c(C)n1C
BDBM161530 C[C@@H]1Cc2ccccc2CN1C(=O)c1cc2OCOc2cc1-c1cc(C(=O)N(c2ccncc2)c2ccc(O)cc2)c(C)n1C
BDBM161531 COc1cc(C(=O)N2Cc3ccccc3C[C@H]2C)c(cc1F)-c1cc(C(=O)N(c2cnn(C)c2)c2ccc(O)cc2)c(C)n1C
BDBM161532 C[C@@H]1Cc2ccccc2CN1C(=O)c1ccc(Cl)cc1-c1cc(C(=O)N(c2ccc(O)cc2)c2cnc3n(C)ccc3c2)c(C)n1C
BDBM161533 Cc1c(cc(-c2cc3OCOc3cc2C(=O)N2Cc3ccccc3C[C@H]2CN2CCOCC2)n1C)C(=O)N(c1ccccc1)c1cnc2n(C)ccc2c1
BDBM161534 C[C@@H]1Cc2ccccc2CN1C(=O)c1cc(CNC(=O)Oc2ccc(C)cc2)ccc1-c1cc(C(=O)N(C)c2ccc(O)cc2)c(C)n1C
BDBM50400181 Oc1cc2C(=O)c3ccc(Br)cc3C(=O)c2cc1O
BDBM50400182 Oc1cc2C(=O)c3ccccc3C(=O)c2cc1O
BDBM50400183 Oc1cc(O)c2C(=O)c3ccccc3C(=O)c2c1
BDBM50400184 Oc1cc2C(=O)c3ccccc3C(=O)c2c(O)c1O
BDBM161537 CN1CCN(C[C@@H]2Cc3ccccc3CN2C(=O)c2cc3OCOc3cc2-c2cc(C(=O)N(c3ccc(O)cc3)c3cnc4n(C)ccc4c3)c(C)n2C)CC1
BDBM161538 Cc1c(cc(-c2cc(Cl)ccc2C(=O)N2Cc3ccccc3C[C@H]2CN2CCOCC2)n1C)C(=O)N(c1ccc(O)cc1)c1cnc2n(C)ccc2c1
BDBM161536 C[C@@H]1Cc2ccccc2CN1C(=O)c1cc(O)c(F)cc1-c1cc(C(=O)N(c2cnn(C)c2)c2ccc(O)cc2)c(C)n1C
BDBM50427813 CCCCn1c(C)c(C(O)=O)c(c1-c1ccc(Cl)cc1)-c1cccc(c1)N1CCN(CC1)c1ccc(NS(=O)(=O)c2ccc(N[C@H](CCN(C)C)CSc3ccccc3)c(c2)[N+]([O-])=O)cc1 |r|
BDBM50426423 CN(C)CC[C@H](CSc1ccccc1)Nc1ccc(cc1[N+]([O-])=O)S(=O)(=O)Nc1cccc2cc(cnc12)N1CCN(Cc2ccccc2-c2ccc(Cl)cc2)CC1 |r|
BDBM50426424 [O-][N+](=O)c1cc(ccc1N[C@H](CCN1CCOCC1)CSc1ccccc1)S(=O)(=O)Nc1cccc2cc(ccc12)N1CCN(Cc2ccccc2-c2ccc(Cl)cc2)CC1 |r|
BDBM50426412 CN(C)CC[C@H](CSc1ccccc1)Nc1ccc(cc1S(=O)(=O)C(F)(F)F)S(=O)(=O)Nc1nc(nc2CN(CCc12)C1CCN(Cc2ccccc2-c2ccc(Cl)cc2)CC1)C(F)(F)F |r|
BDBM50426413 CN(C)CC[C@H](CSc1ccccc1)Nc1ccc(cc1S(=O)(=O)C(F)(F)F)S(=O)(=O)Nc1nc(Cl)nc2CN(CCc12)C1CCN(Cc2ccccc2-c2ccc(Cl)cc2)CC1 |r|
BDBM50426414 CN(C)CC[C@H](CSc1ccccc1)Nc1ccc(cc1S(=O)(=O)C(F)(F)F)S(=O)(=O)Nc1ncnc2C(=O)N(CCc12)C1CCN(Cc2cc(F)ccc2-c2ccc(Cl)cc2)CC1 |r|
BDBM50426415 CC(N1CCC(CC1)N1CCc2c(C1)ncnc2NS(=O)(=O)c1ccc(N[C@H](CCN(C)C)CSc2ccccc2)c(c1)S(=O)(=O)C(F)(F)F)c1ccccc1-c1ccc(Cl)cc1 |r|
BDBM50427814 CCCn1c(C)c(C(O)=O)c(c1-c1ccc(Cl)cc1)-c1cccc(c1)N1CCN(CC1)c1ccc(NS(=O)(=O)c2ccc(N[C@H](CCN(C)C)CSc3ccccc3)c(c2)[N+]([O-])=O)cc1 |r|
BDBM50427815 CN(C)CC[C@H](CSc1ccccc1)Nc1ccc(cc1[N+]([O-])=O)S(=O)(=O)Nc1ccc(cc1)N1CCN(CC1)c1cccc(c1)-c1c(oc(C)c1C(O)=O)-c1ccc(Cl)cc1 |r|
BDBM50427816 CN(C)CC[C@H](CSc1ccccc1)Nc1ccc(cc1[N+]([O-])=O)S(=O)(=O)Nc1ccc(cc1)N1CCN(CC1)c1cccc(c1)-c1c(nn(C)c1C(O)=O)-c1ccc(Cl)cc1 |r|
BDBM50427817 CN(C)CC[C@H](CSc1ccccc1)Nc1ccc(cc1[N+]([O-])=O)S(=O)(=O)Nc1ccc(cc1)N1CCN(CC1)c1cccc(c1)-c1c(nn(C)c1-c1ccc(Cl)cc1)C(O)=O |r|
BDBM50427818 CN(C)CC[C@H](CSc1ccccc1)Nc1ccc(cc1[N+]([O-])=O)S(=O)(=O)Nc1ccc(cc1)N1CCN(CC1)c1cccc(c1)-c1c(cnn1-c1ccc(Cl)cc1)C(=O)NS(C)(=O)=O |r|
BDBM50427819 CN(C)CC[C@H](CSc1ccccc1)Nc1ccc(cc1[N+]([O-])=O)S(=O)(=O)Nc1ccc(cc1)N1CCN(CC1)c1cccc(c1)-c1c(ncn1-c1ccc(Cl)cc1)C(=O)NS(C)(=O)=O |r|
BDBM50427820 CN(C)CCC(CSc1ccccc1)Nc1ccc(cc1[N+]([O-])=O)S(=O)(=O)Nc1ccc(cc1)N1CCN(CC1)c1cccc(c1)-c1c[n-][o+]c1-c1ccc(Cl)cc1
BDBM50427821 CN(C)CC[C@H](CSc1ccccc1)Nc1ccc(cc1[N+]([O-])=O)S(=O)(=O)Nc1ccc(cc1)N1CCN(CC1)c1cccc(c1)-c1cn(C)nc1-c1ccc(Cl)cc1 |r|
BDBM50427822 CN(C)CC[C@H](CSc1ccccc1)Nc1ccc(cc1[N+]([O-])=O)S(=O)(=O)Nc1ccc(cc1)N1CCN(CC1)c1cccc(c1)-c1cnn(C)c1-c1ccc(Cl)cc1 |r|
BDBM50427823 CN(C)CC[C@H](CSc1ccccc1)Nc1ccc(cc1[N+]([O-])=O)S(=O)(=O)Nc1ccc(cc1)N1CCN(CC1)c1cccc(c1)-c1ccnn1-c1ccc(Cl)cc1 |r|
BDBM50427824 CN(C)CC[C@H](CSc1ccccc1)Nc1ccc(cc1[N+]([O-])=O)S(=O)(=O)Nc1ccc(cc1)N1CCN(CC1)c1cccc(c1)-c1cncn1-c1ccc(Cl)cc1 |r|
BDBM50427825 CN(C)CC[C@H](CSc1ccccc1)Nc1ccc(cc1[N+]([O-])=O)S(=O)(=O)Nc1ccc(cc1)N1CCN(CC1)c1cccc(c1)-c1c(C(O)=O)c(Cl)n(C)c1-c1ccc(Cl)cc1 |r|
BDBM50427826 CN(C)CC[C@H](CSc1ccccc1)Nc1ccc(cc1[N+]([O-])=O)S(=O)(=O)Nc1ccc(cc1)N1CCN(CC1)c1cccc(c1)-c1c(C(O)=O)c(n(C)c1-c1ccc(Cl)cc1)C(F)(F)F |r|
BDBM50427827 CN(C)CC[C@H](CSc1ccccc1)Nc1ccc(cc1[N+]([O-])=O)S(=O)(=O)Nc1ccc(cc1)N1CCN(CC1)c1cccc(c1)-c1c(C#N)c(C)n(C)c1-c1ccc(Cl)cc1 |r|
BDBM50427828 CN(C)CC[C@H](CSc1ccccc1)Nc1ccc(cc1[N+]([O-])=O)S(=O)(=O)Nc1ccc(cc1)N1CCN(CC1)c1cccc(c1)-c1c(-c2ccc(Cl)cc2)n(C)c(C)c1C(F)(F)F |r|
BDBM50427829 CN(C)CC[C@H](CSc1ccccc1)Nc1ccc(cc1[N+]([O-])=O)S(=O)(=O)Nc1ccc(cc1)N1CCN(CC1)c1cccc(c1)-c1c(Cl)c(C)n(C)c1-c1ccc(Cl)cc1 |r|
BDBM50427830 CN(C)CC[C@H](CSc1ccccc1)Nc1ccc(cc1[N+]([O-])=O)S(=O)(=O)Nc1ccc(cc1)N1CCN(CC1)c1cccc(c1)-c1c(C(=O)NS(C)(=O)=O)c(C)n(C)c1-c1ccc(Cl)cc1 |r|
BDBM50427831 CN(C)CC[C@H](CSc1ccccc1)Nc1ccc(cc1[N+]([O-])=O)S(=O)(=O)Nc1ccc(cc1)N1CCN(CC1)c1cccc(c1)-c1c(C(=O)N2CC(C)(O)C2)c(C)n(C)c1-c1ccc(Cl)cc1 |r|
BDBM50426416 CN(C)CC[C@H](CSc1ccccc1)Nc1ccc(cc1S(=O)(=O)C(F)(F)F)S(=O)(=O)Nc1ncnc2CN(CCc12)C1CCN(Cc2cc(F)ccc2-c2ccc(Cl)cc2)CC1 |r|
BDBM50427832 CN(C)CC[C@H](CSc1ccccc1)Nc1ccc(cc1[N+]([O-])=O)S(=O)(=O)Nc1ccc(cc1)N1CCN(CC1)c1cccc(c1)-c1c(C(=O)N[C@H]2C[C@@](C)(O)C2)c(C)n(C)c1-c1ccc(Cl)cc1 |r,wU:53.59,5.14,51.55,wD:53.58,(25.19,-28.45,;26.52,-27.68,;27.85,-28.44,;26.52,-26.14,;27.85,-25.36,;27.85,-23.82,;29.18,-23.05,;30.51,-23.82,;31.85,-23.05,;33.18,-23.83,;34.51,-23.06,;34.51,-21.51,;33.16,-20.75,;31.84,-21.52,;26.51,-23.06,;25.18,-23.83,;25.18,-25.37,;23.85,-26.13,;22.52,-25.36,;22.51,-23.83,;23.84,-23.06,;23.83,-21.51,;25.17,-20.74,;22.5,-20.75,;21.19,-26.13,;21.95,-27.46,;20.42,-27.45,;19.85,-25.37,;18.52,-26.14,;18.53,-27.69,;17.19,-28.46,;15.85,-27.69,;15.86,-26.15,;17.19,-25.38,;14.52,-28.46,;13.19,-27.69,;11.86,-28.45,;11.85,-29.99,;13.18,-30.77,;14.53,-30,;10.52,-30.75,;10.52,-32.29,;9.18,-33.05,;7.85,-32.28,;7.85,-30.74,;9.19,-29.97,;6.52,-29.96,;6.36,-28.43,;7.51,-27.4,;8.97,-27.88,;7.2,-25.89,;8.35,-24.87,;8.44,-23.33,;9.97,-23.41,;11.51,-23.4,;10.73,-22.07,;9.88,-24.95,;4.86,-28.1,;4.24,-26.69,;4.09,-29.43,;2.55,-29.58,;5.11,-30.58,;4.78,-32.08,;3.31,-32.54,;2.98,-34.04,;4.12,-35.08,;3.79,-36.59,;5.59,-34.61,;5.92,-33.11,)|
BDBM50427833 CN(C)CC[C@H](CSc1ccccc1)Nc1ccc(cc1[N+]([O-])=O)S(=O)(=O)Nc1ccc(cc1)N1CCN(CC1)c1cccc(c1)-c1c(C(N)=O)c(C)n(C)c1-c1ccc(Cl)cc1 |r|
BDBM50426417 CN(C)CC[C@H](CSc1ccccc1)Nc1ccc(cc1S(=O)(=O)C(F)(F)F)S(=O)(=O)Nc1ncnc2CN(CCc12)C1CCN(Cc2ccccc2-c2ccc(Cl)cc2)CC1 |r|
BDBM50426418 CN(C)CC[C@H](CSc1ccccc1)Nc1ccc(cc1S(=O)(=O)C(F)(F)F)S(=O)(=O)Nc1nnc2CCN(CCn12)C1CCN(Cc2ccccc2-c2ccc(Cl)cc2)CC1 |r|
BDBM50426419 FC(F)(F)S(=O)(=O)c1cc(ccc1N[C@H](CCN1CCOCC1)CSc1ccccc1)S(=O)(=O)Nc1ncnc2CN(Cc12)C1CCN(Cc2ccccc2-c2ccc(Cl)cc2)CC1 |r|
BDBM50426420 CN(C)CCC(CSc1ccccc1)Nc1ccc(cc1[N+]([O-])=O)S(=O)(=O)N[C+]1[N-]S(=O)(=O)c2cc(ccc12)N1CCN(Cc2ccccc2-c2ccc(Cl)cc2)CC1
BDBM50426421 CN(C)CC[C@H](CSc1ccccc1)Nc1ccc(cc1[N+]([O-])=O)S(=O)(=O)Nc1nnc2cc(cnn12)N1CCN(Cc2ccccc2-c2ccc(Cl)cc2)CC1 |r|
BDBM50426422 CN(C)CC[C@H](CSc1ccccc1)Nc1ccc(cc1[N+]([O-])=O)S(=O)(=O)Nc1nn(C)c2nc(ncc12)N1CCN(Cc2ccccc2-c2ccc(Cl)cc2)CC1 |r|
BDBM50427811 CC(C)n1c(C)c(C(=O)NS(C)(=O)=O)c(c1-c1ccc(Cl)cc1)-c1cccc(c1)N1CCN(CC1)c1ccc(NS(=O)(=O)c2ccc(N[C@H](CCN(C)C)CSc3ccccc3)c(c2)[N+]([O-])=O)cc1 |r|
BDBM50427812 CCn1c(C)c(C(=O)NS(C)(=O)=O)c(c1-c1ccc(Cl)cc1)-c1cccc(c1)N1CCN(CC1)c1ccc(NS(=O)(=O)c2ccc(N[C@H](CCN(C)C)CSc3ccccc3)c(c2)[N+]([O-])=O)cc1 |r|
BDBM161542 C[C@@H]1Cc2ccccc2CN1C(=O)c1cc2OCOc2cc1-c1cc(C(=O)N(c2cnn(C)c2)c2ccc(O)cc2)c(CN2CCOCC2)n1C
BDBM161543 CCn1c(C)c(cc1-c1cc2OCOc2cc1C(=O)N1Cc2ccccc2C[C@H]1CN1CCOCC1)C(=O)N(c1cnn(C)c1)c1ccc(O)cc1
BDBM161544 COCCn1c(C)c(cc1-c1cc2OCOc2cc1C(=O)N1Cc2ccccc2C[C@H]1CN1CCOCC1)C(=O)N(c1cnn(C)c1)c1ccc(O)cc1
BDBM161545 Cc1c(cc(-c2cc3OCOc3cc2C(=O)N2Cc3ccccc3C[C@H]2CN2CCOCC2)n1CCF)C(=O)N(c1cnn(C)c1)c1ccc(O)cc1
BDBM161546 Cc1c(cc(-c2cc3OCOc3cc2C(=O)N2Cc3ccccc3C[C@H]2CN2CCOCC2)n1CC(F)F)C(=O)N(c1cnn(C)c1)c1ccc(O)cc1
BDBM161547 C[C@@H]1Cc2ccccc2CN1C(=O)c1cc2OCOc2cc1-c1cc(C(=O)N(c2cnn(C)c2)c2ccc(O)cc2)c(C)n1CCN1CCOCC1
BDBM161548 C[C@@H]1Cc2ccccc2CN1C(=O)c1cc2OCOc2cc1-c1cc(C(=O)N(c2ccccc2)c2ccc(O)cc2)c(C)n1CCN1CCOCC1
BDBM161549 C[C@@H]1Cc2ccccc2CN1C(=O)c1cc2OCOc2cc1-c1cc(C(=O)N(c2ccccc2)c2ccc(O)cc2)c(C)n1CCN(C)C
BDBM161550 COCCN(C)CCn1c(C)c(cc1-c1cc2OCOc2cc1C(=O)N1Cc2ccccc2C[C@H]1C)C(=O)N(c1cnn(C)c1)c1ccc(O)cc1
BDBM161551 COc1cc(C(=O)N2Cc3ccccc3C[C@H]2CN2CCOCC2)c(cc1F)-c1[nH]c(C)c(C(=O)N(c2cnn(C)c2)c2ccc(O)cc2)c1C
BDBM161552 COc1cc(-c2cc(C(=O)N(c3cnn(C)c3)c3ccc(O)cc3)c(C)n2C)c(cc1F)C(=O)N1Cc2ccccc2C[C@H]1CN1CCOCC1
BDBM161553 CN1CCN(C[C@@H]2Cc3ccccc3CN2C(=O)c2ccc(Cl)cc2-c2cc(C(=O)N(c3ccc(O)cc3)c3cnc4n(C)ccc4c3)c(C)n2C)CC1
BDBM161555 Cc1c(cc(-c2cc(Cl)ccc2C(=O)N2Cc3ccccc3C[C@H]2CN2CCOCC2)n1C)C(=O)N(c1ccc(O)cc1)c1cccc(n1)C#N
BDBM161558 Cc1c(cc(-c2cc(Cl)ccc2C(=O)N2Cc3ccccc3C[C@H]2CN2CCN3CCOC[C@H]3C2)n1C)C(=O)N(c1cnn(C)c1)c1ccc(O)cc1
BDBM161556 Cc1c(cc(-c2cc(Cl)ccc2C(=O)N2Cc3ccccc3C[C@H]2CN2CCOCC2)n1C)C(=O)N(c1ccc(O)cc1)c1cc(ccn1)C#N
BDBM161557 Cc1c(cc(-c2cc(Cl)ccc2C(=O)N2Cc3ccccc3C[C@H]2CN2CCN3CCOC[C@@H]3C2)n1C)C(=O)N(c1cnn(C)c1)c1ccc(O)cc1
BDBM161559 Cc1c(cc(-c2cc(Cl)ccc2C(=O)N2Cc3ccccc3C[C@H]2CN2CCOCC2)n1C)C(=O)N(c1cnn(c1)C1CC1)c1ccc(O)cc1
BDBM161562 CN1CCc2cc(cnc12)N(C(=O)c1cc(-c2cc(Cl)ccc2C(=O)N2Cc3ccccc3C[C@H]2CN2CCOCC2)n(C)c1C)c1ccccc1
BDBM161560 Cc1c(cc(-c2cc(Cl)ccc2C(=O)N2Cc3ccccc3C[C@H]2CN2CCOCC2)n1C)C(=O)N(c1cnn(c1)C1COC1)c1ccc(O)cc1
BDBM161561 Cc1c(cc(-c2cc(Cl)ccc2C(=O)N2Cc3ccccc3C[C@H]2CN2CCOCC2)n1C)C(=O)N(c1cnn(c1)C1CCOC1)c1ccc(O)cc1
BDBM161564 COc1cc(C(=O)N2Cc3ccccc3C[C@H]2CN2CCOCC2)c(cc1F)-c1cc(C(=O)N(c2ccc(O)cc2)c2cnc3n(C)ccc3c2)c(C)n1C
BDBM161563 Cc1c(cc(-c2cc(Cl)ccc2C(=O)N2Cc3ccccc3C[C@H]2CN2CC3(CCO3)C2)n1C)C(=O)N(c1cnn(C)c1)c1ccc(O)cc1
BDBM161566 Cc1c(cc(-c2cc(F)ccc2C(=O)N2Cc3ccccc3C[C@H]2CN2CCOCC2)n1C)C(=O)N(c1cnn(c1)C1CC1)c1ccc(O)cc1
BDBM161567 Cc1c(cc(-c2cc(F)ccc2C(=O)N2Cc3ccccc3C[C@H]2CN2CCOCC2)n1C)C(=O)N(c1cc(C#N)n(C)c1)c1ccc(O)cc1
BDBM161565 COc1cc(C(=O)N2Cc3ccccc3C[C@H]2CN2CCOCC2)c(cc1F)-c1cc(C(=O)N(c2ccc(O)cc2)c2cnc3N(C)CCc3c2)c(C)n1C
BDBM161568 COCCc1c(cc(-c2cc3OCOc3cc2C(=O)N2Cc3ccccc3C[C@H]2CN2CCOCC2)n1C)C(=O)N(c1ccc(O)cc1)c1cnc2N(C)CCc2c1
BDBM161569 Cc1c(cc(-c2cc(F)ccc2C(=O)N2Cc3ccccc3C[C@H]2CN2CCOCC2)n1C)C(=O)N(c1ccncc1)c1ccc(O)cc1
BDBM161570 Cc1c(cc(-c2cc(F)ccc2C(=O)N2Cc3ccccc3C[C@H]2CN2CCOCC2)n1C)C(=O)N(c1ccc(O)cc1)c1cnc2n(C)ccc2c1
BDBM161573 CN1CCc2cc(cnc12)N(C(=O)c1cc(-c2cc(Cl)ccc2C(=O)N2Cc3ccccc3C[C@H]2CN2CCOCC2)n(C)c1C)c1ccc(O)cc1
BDBM50424717 C(Sc1nnc[nH]1)c1cccc2ccccc12
BDBM50424718 Cc1cc(OCCC(O)=O)cc(C)c1Cl
BDBM50424719 Cc1cc(OCC(O)=O)ccc1Cl
BDBM50424720 Cc1cccc2c(c([nH]c12)C(O)=O)-c1ccccc1
BDBM50424721 Cc1c(oc2c(C)c(C)ccc12)C(O)=O
BDBM50424722 Cc1c(oc2c(C)cccc12)C(O)=O
BDBM50424723 Cc1ccc2c(Cl)c(sc2c1)C(O)=O
BDBM50424724 OC(=O)c1sc2cccc(Cl)c2c1Cl
BDBM50424725 OC(=O)c1sc2cc(Cl)ccc2c1CCCOc1cccc2ccccc12
BDBM50424726 Cc1cc(OCCCc2c(sc3cc(Cl)ccc23)C(O)=O)cc(C)c1Cl
BDBM50424727 Cc1cc(OCCCc2c(sc3ccccc23)C(O)=O)cc(C)c1Cl
BDBM50424728 OC(=O)c1c(CCCOc2cccc3ccccc23)c2ccccc2n1Cc1ccccc1
BDBM50424729 Cn1c(C(O)=O)c(CCCOc2cccc3ccccc23)c2ccccc12
BDBM50424730 Cc1cc(OCCCc2c(C(O)=O)n(C)c3ccccc23)cc(C)c1Cl
BDBM50424731 OC(=O)c1[nH]c2cc(Cl)ccc2c1CCCOc1cccc2ccccc12
BDBM50424732 Cc1cc(OCCCc2c([nH]c3cc(Cl)ccc23)C(O)=O)cc(C)c1Cl
BDBM50424733 Cc1cc(OCCCc2c([nH]c3cc(Cl)ccc23)C(O)=O)ccc1Cl
BDBM50424734 OC(=O)c1[nH]c2ccccc2c1CCCOc1cccc2ccccc12
BDBM50424735 Cc1cc(OCCCc2c([nH]c3ccccc23)C(O)=O)cc(C)c1Cl
BDBM50424736 Cc1cc(OCCCc2c([nH]c3ccccc23)C(O)=O)ccc1Cl
BDBM50424737 OC(=O)c1oc2ccccc2c1CCCOc1cccc2ccccc12
BDBM50424738 OC(=O)c1sc2ccccc2c1CCCOc1cccc2ccccc12
BDBM50424203 CC(C)c1ccc(Oc2ccc3c4c(NCCCc5ccccc5)c(=O)nc4c4cccc2c34)cc1
BDBM50424204 CCCCCCNc1c2c3ccc(Oc4ccc(cc4)C(C)C)c4cccc(c2nc1=O)c34
BDBM50424205 CCCCNc1c2c3ccc(Oc4ccc(cc4)C(C)C)c4cccc(c2nc1=O)c34
BDBM50424206 OOc1ccc(Sc2ccc3c4c(NCCCc5ccccc5)c(=O)nc4c4cccc2c34)cc1
BDBM50424207 CCCCCCNc1c2c3ccc(Sc4ccc(OC)cc4)c4cccc(c2nc1=O)c34
BDBM50424208 CCCCNc1c2c3ccc(Sc4ccc(OC)cc4)c4cccc(c2nc1=O)c34
BDBM50424209 Nc1ccc(Sc2ccc3c4c(NCCCc5ccccc5)c(=O)nc4c4cccc2c34)cc1
BDBM50424210 CCCCCCNc1c2c3ccc(Sc4ccc(N)cc4)c4cccc(c2nc1=O)c34
BDBM50424211 CCCCNc1c2c3ccc(Sc4ccc(N)cc4)c4cccc(c2nc1=O)c34
BDBM50424212 O=c1nc2c3cccc4c(ccc(c2c1NCCCc1ccccc1)c34)N1CCSCC1
BDBM50424213 CCCCCCNc1c2c3ccc(N4CCSCC4)c4cccc(c2nc1=O)c34
BDBM50424214 CCCCNc1c2c3ccc(N4CCSCC4)c4cccc(c2nc1=O)c34
BDBM50424215 CCCOC(=O)c1c2c3ccc(N4CCSCC4)c4cccc(c2nc1=O)c34
BDBM50424216 CCOC(=O)c1c2c3ccc(N4CCSCC4)c4cccc(c2nc1=O)c34
BDBM50424217 O=c1nc2c3cccc4c(ccc(c2c1NCCCCCc1ccccc1)c34)N1CCSCC1
BDBM50424218 O=c1nc2c3cccc4c(ccc(c2c1NCc1ccccc1)c34)N1CCSCC1
BDBM50424219 CC(C)Nc1c2c3ccc(N4CCSCC4)c4cccc(c2nc1=O)c34
BDBM50432895 Nn1c(SCc2cccc(c2)[N+]([O-])=O)nnc1-c1c[nH]c2ccccc12
BDBM50441891 Oc1cc2c(nc[nH]c2=O)c(O)c1O
BDBM50441885 Oc1cc(C(=O)NCCCc2ccccc2)c(NC(=O)c2ccccc2)c(O)c1O
BDBM50441886 Oc1cc(C(=O)NCc2ccccc2)c(NC(=O)c2ccccc2)c(O)c1O
BDBM50441887 CCCCNC(=O)c1cc(O)c(O)c(O)c1NC(=O)c1ccccc1
BDBM50441888 CC(C)c1ccc(O)c(Cn2c(nc3c(O)c(O)c(O)cc3c2=O)-c2ccccc2)c1
BDBM50441889 Cc1ccc(O)c(Cn2c(nc3c(O)c(O)c(O)cc3c2=O)-c2ccccc2)c1
BDBM50441890 Oc1cc2c(nc(-c3ccccc3)n(Cc3ccccc3)c2=O)c(O)c1O
BDBM50436626 CC(N=Nc1nc2ccccc2s1)c1ccc(s1)-c1cccc(n1)C(O)=O |w:3.3|
BDBM50436628 OC(=O)c1cc(ccn1)-c1ccc2CCCC(=NNc3nc4ccccc4s3)c2c1 |w:17.18|
BDBM50436643 CC(N=Nc1nc2ccccc2s1)c1ccc(o1)-c1cccc(c1)C(O)=O |w:3.3|
BDBM50436645 OC(=O)c1ccnc(n1)-c1ccc2CCCC(=NNc3nc4ccccc4s3)c2c1 |w:17.18|
BDBM50436646 CCN1CCC(=NNc2nc3ccccc3s2)c2cc(ccc12)-c1cccc(n1)C(O)=O |w:6.6|
BDBM50436648 CC(N=Nc1nc2ccccc2s1)c1cccc(c1)-c1cccc(n1)C(O)=O |w:3.3|
BDBM50013862 OC(=O)CSc1cc(NS(=O)(=O)c2ccc(cc2)-c2ccccc2)c2ccccc2c1O
BDBM50013863 OC(=O)CSc1cc(NS(=O)(=O)c2cccc(c2)-c2ccccc2)c2ccccc2c1O
BDBM50013864 OC(=O)CSc1cc(NS(=O)(=O)c2ccccc2-c2ccccc2)c2ccccc2c1O
BDBM50013865 OC(=O)CSc1cc(NS(=O)(=O)c2ccc(cc2)-c2ccc(Cl)cc2)c2ccccc2c1O
BDBM50013867 OC(=O)CSc1cc(NS(=O)(=O)c2ccc(Oc3ccccc3)cc2)c2ccccc2c1O
BDBM50013839 OC(=O)CSc1cc(NS(=O)(=O)c2cccs2)c2ccccc2c1O
BDBM50020919 OC(=O)c1cccc(n1)-c1ccc2CCC\C(=N/Nc3nc4ccccc4s3)c2c1
BDBM50020920 OC(=O)c1csc(n1)-c1ccc2CCC\C(=N/Nc3nc4ccccc4s3)c2c1
BDBM50020929 OC(=O)c1cccc(n1)N1CCc2cccc(C(=O)Nc3nc4ccccc4s3)c2C1
BDBM50020930 OC(=O)c1csc(n1)N1CCc2cccc(C(=O)Nc3nc4ccccc4s3)c2C1
BDBM50020938 OC(=O)c1nc(sc1CCCOc1ccccc1)N1CCc2cccc(C(=O)Nc3nc4ccccc4s3)c2C1
BDBM156394 FC(F)(F)S(=O)(=O)c1cc(ccc1N[C@H](CCN1CCOCC1)CSc1ccccc1)S(=O)(=O)NC(=O)c1ccc(cc1)N1CCC(CC1)[C@@H](C#N)c1ccccc1-c1ccc(Cl)cc1 |r|
BDBM142745 CC(C)c1c(O)c(O)cc2c1c(=O)c(C)c(-c1c(C)c(=O)c3c(C(C)C)c(O)c(O)cc3c1=O)c2=O |(-4.65,-4.76,;-5.98,-3.99,;-7.31,-4.76,;-5.98,-2.45,;-7.31,-1.68,;-8.65,-2.45,;-7.31,-.14,;-8.65,.63,;-5.98,.63,;-4.65,-.14,;-4.65,-1.68,;-3.31,-2.45,;-3.31,-3.99,;-1.98,-1.68,;-.65,-2.45,;-1.98,-.14,;-.65,.63,;-.65,2.17,;-1.98,2.94,;.69,2.94,;.69,4.48,;2.02,2.17,;3.36,2.94,;3.36,4.48,;2.02,5.25,;4.69,5.25,;4.69,2.17,;6.02,2.94,;4.69,.63,;6.02,-.14,;3.36,-.14,;2.02,.63,;.69,-.2,;.69,-1.74,;-3.31,.68,;-3.31,2.22,)|
BDBM142746 CC(CNC(=O)c1c(O)c(O)cc2c1c(=O)c(C)c(-c1c(C)c(=O)c3c(C(=O)NCC(C)c4ccccc4)c(O)c(O)cc3c1=O)c2=O)c1ccccc1 |(7.36,6.79,;6.02,7.56,;4.69,6.79,;4.69,5.25,;3.36,4.48,;2.02,5.25,;3.36,2.94,;4.69,2.17,;6.02,2.94,;4.69,.63,;6.02,-.14,;3.36,-.14,;2.02,.63,;2.02,2.17,;.69,2.94,;.69,4.48,;-.65,2.17,;-1.98,2.94,;-.65,.63,;-1.98,-.14,;-1.98,-1.68,;-.65,-2.45,;-3.31,-2.45,;-3.31,-3.99,;-4.65,-1.68,;-5.98,-2.45,;-5.98,-3.99,;-4.65,-4.76,;-7.31,-4.76,;-7.31,-6.3,;-8.65,-7.07,;-9.98,-6.3,;-8.65,-8.61,;-9.98,-9.38,;-9.98,-10.92,;-8.65,-11.69,;-7.31,-10.92,;-7.31,-9.38,;-7.31,-1.68,;-8.65,-2.45,;-7.31,-.14,;-8.65,.63,;-5.98,.63,;-4.65,-.14,;-3.31,.68,;-3.31,2.22,;.69,-.2,;.69,-1.74,;6.02,9.1,;4.69,9.87,;4.69,11.41,;6.02,12.18,;7.36,11.41,;7.36,9.87,)|
BDBM142748 CCc1ccc(CCNC(=O)c2c(O)c(O)cc3c2c(=O)c(C)c(-c2c(C)c(=O)c4c(C(=O)NCCc5ccc(CC)cc5)c(O)c(O)cc4c2=O)c3=O)cc1 |(-7.31,-14,;-8.65,-13.23,;-8.65,-11.69,;-9.98,-10.92,;-9.98,-9.38,;-8.65,-8.61,;-8.65,-7.07,;-7.31,-6.3,;-7.31,-4.76,;-5.98,-3.99,;-4.65,-4.76,;-5.98,-2.45,;-7.31,-1.68,;-8.65,-2.45,;-7.31,-.14,;-8.65,.63,;-5.98,.63,;-4.65,-.14,;-4.65,-1.68,;-3.31,-2.45,;-3.31,-3.99,;-1.98,-1.68,;-.65,-2.45,;-1.98,-.14,;-.65,.63,;-.65,2.17,;-1.98,2.94,;.69,2.94,;.69,4.48,;2.02,2.17,;3.36,2.94,;3.36,4.48,;2.02,5.25,;4.69,5.25,;4.69,6.79,;6.02,7.56,;6.02,9.1,;4.69,9.87,;4.69,11.41,;6.02,12.18,;6.02,13.72,;7.36,14.49,;7.36,11.41,;7.36,9.87,;4.69,2.17,;6.02,2.94,;4.69,.63,;6.02,-.14,;3.36,-.14,;2.02,.63,;.69,-.2,;.69,-1.74,;-3.31,.68,;-3.31,2.22,;-7.31,-9.38,;-7.31,-10.92,)|
BDBM142749 Cc1c(-c2c(C)c(=O)c3c(C(=O)Cc4ccccc4)c(O)c(O)cc3c2=O)c(=O)c2cc(O)c(O)c(C(=O)Cc3ccccc3)c2c1=O |(-.65,-2.45,;-1.98,-1.68,;-1.98,-.14,;-.65,.63,;-.65,2.17,;-1.98,2.94,;.69,2.94,;.69,4.48,;2.02,2.17,;3.36,2.94,;3.36,4.48,;2.02,5.25,;4.69,5.25,;4.69,6.79,;3.35,7.56,;3.35,9.1,;4.69,9.87,;6.02,9.1,;6.02,7.56,;4.69,2.17,;6.02,2.94,;4.69,.63,;6.02,-.14,;3.36,-.14,;2.02,.63,;.69,-.2,;.69,-1.74,;-3.31,.68,;-3.31,2.22,;-4.65,-.14,;-5.98,.63,;-7.31,-.14,;-8.65,.63,;-7.31,-1.68,;-8.65,-2.45,;-5.98,-2.45,;-5.98,-3.99,;-4.65,-4.76,;-7.31,-4.76,;-7.31,-6.3,;-8.65,-7.07,;-8.65,-8.61,;-7.31,-9.38,;-5.98,-8.61,;-5.98,-7.07,;-4.65,-1.68,;-3.31,-2.45,;-3.31,-3.99,)|
BDBM142750 CC(C)Cc1c(O)c(O)cc2c1c(=O)c(C)c(-c1c(C)c(=O)c3c(CC(C)C)c(O)c(O)cc3c1=O)c2=O |(-7.31,-6.3,;-7.31,-4.76,;-8.65,-3.99,;-5.98,-3.99,;-5.98,-2.45,;-7.31,-1.68,;-8.65,-2.45,;-7.31,-.14,;-8.65,.63,;-5.98,.63,;-4.65,-.14,;-4.65,-1.68,;-3.31,-2.45,;-3.31,-3.99,;-1.98,-1.68,;-.65,-2.45,;-1.98,-.14,;-.65,.63,;-.65,2.17,;-1.98,2.94,;.69,2.94,;.69,4.48,;2.02,2.17,;3.36,2.94,;3.36,4.48,;4.69,5.25,;4.69,6.79,;6.02,4.48,;4.69,2.17,;6.02,2.94,;4.69,.63,;6.02,-.14,;3.36,-.14,;2.02,.63,;.69,-.2,;.69,-1.74,;-3.31,.68,;-3.31,2.22,)|
BDBM142751 Cc1c(-c2c(C)c(=O)c3c(CC4CCCC4)c(O)c(O)cc3c2=O)c(=O)c2cc(O)c(O)c(CC3CCCC3)c2c1=O |(-.65,-2.45,;-1.98,-1.68,;-1.98,-.14,;-.65,.63,;-.65,2.17,;-1.98,2.94,;.69,2.94,;.69,4.48,;2.02,2.17,;3.36,2.94,;3.36,4.48,;4.69,5.25,;5.01,6.75,;6.54,6.91,;7.17,5.51,;6.02,4.48,;4.69,2.17,;6.02,2.94,;4.69,.63,;6.02,-.14,;3.36,-.14,;2.02,.63,;.69,-.2,;.69,-1.74,;-3.31,.68,;-3.31,2.22,;-4.65,-.14,;-5.98,.63,;-7.31,-.14,;-8.65,.63,;-7.31,-1.68,;-8.65,-2.45,;-5.98,-2.45,;-5.98,-3.99,;-7.31,-4.76,;-8.56,-3.86,;-9.81,-4.76,;-9.33,-6.23,;-7.79,-6.23,;-4.65,-1.68,;-3.31,-2.45,;-3.31,-3.99,)|
BDBM142752 Cc1c(-c2c(C)c(=O)c3c(CCC4CCCCC4)c(O)c(O)cc3c2=O)c(=O)c2cc(O)c(O)c(CCC3CCCCC3)c2c1=O |(-.65,-2.45,;-1.98,-1.68,;-1.98,-.14,;-.65,.63,;-.65,2.17,;-1.98,2.94,;.69,2.94,;.69,4.48,;2.02,2.17,;3.36,2.94,;3.36,4.48,;4.69,5.25,;4.69,6.79,;3.35,7.56,;3.35,9.1,;4.69,9.87,;6.02,9.1,;6.02,7.56,;4.69,2.17,;6.02,2.94,;4.69,.63,;6.02,-.14,;3.36,-.14,;2.02,.63,;.69,-.2,;.69,-1.74,;-3.31,.68,;-3.31,2.22,;-4.65,-.14,;-5.98,.63,;-7.31,-.14,;-8.65,.63,;-7.31,-1.68,;-8.65,-2.45,;-5.98,-2.45,;-5.98,-3.99,;-7.31,-4.76,;-7.31,-6.3,;-8.65,-7.07,;-8.65,-8.61,;-7.31,-9.38,;-5.98,-8.61,;-5.98,-7.07,;-4.65,-1.68,;-3.31,-2.45,;-3.31,-3.99,)|
BDBM142753 Cc1c(-c2c(C)c(=O)c3c(CCc4ccccc4)c(O)c(O)cc3c2=O)c(=O)c2cc(O)c(O)c(CCc3ccccc3)c2c1=O |(-.65,-2.45,;-1.98,-1.68,;-1.98,-.14,;-.65,.63,;-.65,2.17,;-1.98,2.94,;.69,2.94,;.69,4.48,;2.02,2.17,;3.36,2.94,;3.36,4.48,;4.69,5.25,;4.69,6.79,;3.35,7.56,;3.35,9.1,;4.69,9.87,;6.02,9.1,;6.02,7.56,;4.69,2.17,;6.02,2.94,;4.69,.63,;6.02,-.14,;3.36,-.14,;2.02,.63,;.69,-.2,;.69,-1.74,;-3.31,.68,;-3.31,2.22,;-4.65,-.14,;-5.98,.63,;-7.31,-.14,;-8.65,.63,;-7.31,-1.68,;-8.65,-2.45,;-5.98,-2.45,;-5.98,-3.99,;-7.31,-4.76,;-7.31,-6.3,;-8.65,-7.07,;-8.65,-8.61,;-7.31,-9.38,;-5.98,-8.61,;-5.98,-7.07,;-4.65,-1.68,;-3.31,-2.45,;-3.31,-3.99,)|
BDBM142754 Cc1ccc(CCc2c(O)c(O)cc3c2c(=O)c(C)c(-c2c(C)c(=O)c4c(CCc5ccc(C)cc5)c(O)c(O)cc4c2=O)c3=O)cc1 |(-7.31,-10.92,;-7.31,-9.38,;-8.65,-8.61,;-8.65,-7.07,;-7.31,-6.3,;-7.31,-4.76,;-5.98,-3.99,;-5.98,-2.45,;-7.31,-1.68,;-8.65,-2.45,;-7.31,-.14,;-8.65,.63,;-5.98,.63,;-4.65,-.14,;-4.65,-1.68,;-3.31,-2.45,;-3.31,-3.99,;-1.98,-1.68,;-.65,-2.45,;-1.98,-.14,;-.65,.63,;-.65,2.17,;-1.98,2.94,;.69,2.94,;.69,4.48,;2.02,2.17,;3.36,2.94,;3.36,4.48,;4.69,5.25,;4.69,6.79,;3.35,7.56,;3.35,9.1,;4.69,9.87,;4.69,11.41,;6.02,9.1,;6.02,7.56,;4.69,2.17,;6.02,2.94,;4.69,.63,;6.02,-.14,;3.36,-.14,;2.02,.63,;.69,-.2,;.69,-1.74,;-3.31,.68,;-3.31,2.22,;-5.98,-7.07,;-5.98,-8.61,)|
BDBM142755 Cc1c(-c2c(C)c(=O)c3c(CCCc4ccccc4)c(O)c(O)cc3c2=O)c(=O)c2cc(O)c(O)c(CCCc3ccccc3)c2c1=O |(-.65,-2.45,;-1.98,-1.68,;-1.98,-.14,;-.65,.63,;-.65,2.17,;-1.98,2.94,;.69,2.94,;.69,4.48,;2.02,2.17,;3.36,2.94,;3.36,4.48,;4.69,5.25,;4.69,6.79,;6.02,7.56,;6.02,9.1,;7.36,9.87,;8.69,9.1,;8.69,7.56,;7.36,6.79,;4.69,2.17,;6.02,2.94,;4.69,.63,;6.02,-.14,;3.36,-.14,;2.02,.63,;.69,-.2,;.69,-1.74,;-3.31,.68,;-3.31,2.22,;-4.65,-.14,;-5.98,.63,;-7.31,-.14,;-8.65,.63,;-7.31,-1.68,;-8.65,-2.45,;-5.98,-2.45,;-5.98,-3.99,;-7.31,-4.76,;-7.31,-6.3,;-8.65,-7.07,;-9.98,-6.3,;-11.32,-7.07,;-11.32,-8.61,;-9.98,-9.38,;-8.65,-8.61,;-4.65,-1.68,;-3.31,-2.45,;-3.31,-3.99,)|
BDBM142756 Cc1c(-c2c(C)c(=O)c3c(Cc4ccccc4)c(O)c(O)cc3c2=O)c(=O)c2cc(O)c(O)c(Cc3ccccc3)c2c1=O |(-.65,-2.45,;-1.98,-1.68,;-1.98,-.14,;-.65,.63,;-.65,2.17,;-1.98,2.94,;.69,2.94,;.69,4.48,;2.02,2.17,;3.36,2.94,;3.36,4.48,;4.69,5.25,;4.69,6.79,;6.02,7.56,;7.36,6.79,;7.36,5.25,;6.02,4.48,;4.69,2.17,;6.02,2.94,;4.69,.63,;6.02,-.14,;3.36,-.14,;2.02,.63,;.69,-.2,;.69,-1.74,;-3.31,.68,;-3.31,2.22,;-4.65,-.14,;-5.98,.63,;-7.31,-.14,;-8.65,.63,;-7.31,-1.68,;-8.65,-2.45,;-5.98,-2.45,;-5.98,-3.99,;-7.31,-4.76,;-8.65,-3.99,;-9.98,-4.76,;-9.98,-6.3,;-8.65,-7.07,;-7.31,-6.3,;-4.65,-1.68,;-3.31,-2.45,;-3.31,-3.99,)|
BDBM142757 Cc1c(-c2c(C)c(=O)c3c(Cc4ccc(Cl)cc4)c(O)c(O)cc3c2=O)c(=O)c2cc(O)c(O)c(Cc3ccc(Cl)cc3)c2c1=O |(-.65,-2.45,;-1.98,-1.68,;-1.98,-.14,;-.65,.63,;-.65,2.17,;-1.98,2.94,;.69,2.94,;.69,4.48,;2.02,2.17,;3.36,2.94,;3.36,4.48,;4.69,5.25,;4.69,6.79,;6.02,7.56,;7.36,6.79,;8.69,7.56,;7.36,5.25,;6.02,4.48,;4.69,2.17,;6.02,2.94,;4.69,.63,;6.02,-.14,;3.36,-.14,;2.02,.63,;.69,-.2,;.69,-1.74,;-3.31,.68,;-3.31,2.22,;-4.65,-.14,;-5.98,.63,;-7.31,-.14,;-8.65,.63,;-7.31,-1.68,;-8.65,-2.45,;-5.98,-2.45,;-5.98,-3.99,;-7.31,-4.76,;-8.65,-3.99,;-9.98,-4.76,;-9.98,-6.3,;-11.32,-7.07,;-8.65,-7.07,;-7.31,-6.3,;-4.65,-1.68,;-3.31,-2.45,;-3.31,-3.99,)|
BDBM161600 COc1ccc(-c2cc(C(=O)N(c3cc(C#N)n(C)c3C)c3ccc(O)cc3)c(C)n2C)c(c1)C(=O)N1Cc2ccccc2C[C@H]1CN1CCOCC1
BDBM47130 CN1CCC(CC1)Nc1ccc(cc1[N+]([O-])=O)S(=O)(=O)NC(=O)c1ccc(cc1Oc1ccccc1Cl)N1CCN(CC2=C(CC(C)(C)CC2)c2ccc(Cl)cc2)CC1 |t:46|
BDBM47127 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(NCCCN4CCCC4)c(c3)[N+]([O-])=O)c(Oc3cccc(Cl)c3F)c2)=C(C1)c1ccc(Cl)cc1 |c:56|
BDBM47129 CN1CCC(CC1)Nc1ccc(cc1[N+]([O-])=O)S(=O)(=O)NC(=O)c1ccc(cc1Oc1cccc(O)c1C)N1CCN(CC2=C(CC(C)(C)CC2)c2ccc(Cl)cc2)CC1 |t:47|
BDBM145123 FC(F)(F)S(=O)(=O)c1cc(ccc1NC1CCC(CC1)N1CCOCC1)S(=O)(=O)NC(=O)c1ccc(cc1Oc1cc2cc[nH]c2cc1Cl)N1CCN(CC2=C(CCOCC2)c2ccc(Cl)cc2)CC1 |t:60,(.91,8.21,;2.25,7.44,;3.58,6.67,;1.48,6.11,;3.02,8.77,;3.79,10.11,;1.68,9.54,;4.35,8,;4.35,6.46,;5.69,5.69,;7.02,6.46,;7.02,8,;5.69,8.77,;5.69,10.31,;7.02,11.08,;7.02,12.62,;8.35,13.39,;9.69,12.62,;9.69,11.08,;8.35,10.31,;11.02,13.39,;11.02,14.93,;12.35,15.7,;13.69,14.93,;13.69,13.39,;12.35,12.62,;5.69,4.15,;7.23,4.15,;4.15,4.15,;5.69,2.61,;4.35,1.84,;3.02,2.61,;4.35,.3,;5.69,-.47,;5.69,-2.01,;4.35,-2.78,;3.02,-2.01,;3.02,-.47,;1.68,.3,;.35,-.47,;-.98,.3,;-2.32,-.47,;-3.78,.01,;-4.69,-1.24,;-3.78,-2.48,;-2.32,-2.01,;-.98,-2.78,;.35,-2.01,;1.68,-2.78,;4.35,-4.32,;5.69,-5.09,;5.69,-6.63,;4.35,-7.4,;4.35,-8.94,;3.02,-9.71,;3.13,-11.24,;2,-12.29,;.48,-12.06,;-.29,-10.73,;.27,-9.29,;1.75,-8.84,;4.57,-11.8,;5.77,-10.84,;7.2,-11.41,;7.43,-12.93,;8.87,-13.49,;6.23,-13.89,;4.8,-13.33,;3.02,-6.63,;3.02,-5.09,)|
BDBM47135 CC1(C)CC(C(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(OCC4(F)CCOCC4)c(c3)[N+]([O-])=O)c(Oc3cc4cc[nH]c4cc3F)c2)CO1)c1ccc(Cl)cc1
BDBM161578 Cc1c(cc(-c2cc(Cl)ccc2C(=O)N2Cc3ccccc3C[C@H]2CCCN2CCOCC2)n1C)C(=O)N(c1ccc(O)cc1)c1cnc2n(C)ccc2c1
BDBM161582 COc1ncc(cn1)N(C(=O)c1cc(-c2cc(Cl)ccc2C(=O)N2Cc3ccccc3C[C@H]2CN2CCOCC2)n(C)c1C)c1ccc(O)cc1
BDBM161591 COc1ccc(C(=O)N2Cc3ccccc3C[C@H]2CN2CCOCC2)c(c1)-c1cc(C(=O)N(c2cnn(C)c2)c2ccc(O)c(F)c2)c(C)n1C
BDBM161580 COc1ccc(cc1C#N)N(C(=O)c1cc(-c2cc(Cl)ccc2C(=O)N2Cc3ccccc3C[C@H]2CN2CCOCC2)n(C)c1C)c1ccc(O)cc1
BDBM161579 CN1CCc2cc(cnc12)N(C(=O)c1cc(-c2cc(Cl)ccc2C(=O)N2Cc3ccccc3C[C@H]2CCCN2CCOCC2)n(C)c1C)c1ccc(O)cc1
BDBM161583 Cc1c(cc(-c2cc(Cl)ccc2C(=O)N2Cc3ccccc3C[C@H]2CN2CCOCC2)n1C)C(=O)N(c1ccc(O)cc1)c1cccc(c1)C#N
BDBM161584 Cc1c(cc(-c2cc(Cl)ccc2C(=O)N2Cc3ccccc3C[C@H]2CN2CCOCC2)n1C)C(=O)N(c1cnn(C)c1)c1ccc(O)c(F)c1
BDBM161592 COc1ccc(C(=O)N2Cc3ccccc3C[C@H]2CN2CCOCC2)c(c1)-c1cc(C(=O)N(c2cc(C#N)n(C)c2C)c2ccc(O)cc2)c(C)n1C
BDBM161593 Cc1c(cc(-c2ccccc2C(=O)N2Cc3ccccc3C[C@H]2CN2CCOCC2)n1C)C(=O)N(c1ccc(O)cc1)c1cnc2n(C)ccc2c1
BDBM161575 Cc1c(cc(-c2cc(Cl)ccc2C(=O)N2Cc3ccccc3C[C@H]2CN2CCOCC2)n1C)C(=O)N(c1ccccc1)c1cnc2n(C)ccc2c1
BDBM161576 Cc1c(cc(-c2cc(Cl)ccc2C(=O)N2Cc3ccccc3C[C@H]2CN2CCOCC2)n1C)C(=O)N(c1ccc(O)cc1)c1ccc2n(C)ccc2n1
BDBM161577 Cc1c(cc(-c2cc(Cl)ccc2C(=O)N2Cc3ccccc3C[C@H]2CCCN2CCOCC2)n1C)C(=O)N(c1ccccc1)c1ccc(O)cc1
BDBM47131 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(NC4CCN(CC4)C4CCOCC4)c(c3)[N+]([O-])=O)c(Oc3cc4cc[nH]c4cc3C(F)(F)F)c2)=C(C1)c1ccc(Cl)cc1 |c:67|
BDBM144845 CN(C)C(=O)Cc1ccccc1Oc1cc(ccc1C(=O)NS(=O)(=O)c1ccc(NCC2CCOCC2)c(c1)[N+]([O-])=O)N1CCN(Cc2ccccc2-c2ccc(Cl)cc2)CC1
BDBM144846 CN(C)CCCc1ccccc1Oc1cc(ccc1C(=O)NS(=O)(=O)c1ccc(NCC2CCOCC2)c(c1)[N+]([O-])=O)N1CCN(Cc2ccccc2-c2ccc(Cl)cc2)CC1
BDBM144847 CN(C)CCc1ccccc1Oc1cc(ccc1C(=O)NS(=O)(=O)c1ccc(NCC2CCOCC2)c(c1)[N+]([O-])=O)N1CCN(Cc2ccccc2-c2ccc(Cl)cc2)CC1
BDBM144848 CN(C)C(=O)c1ccccc1Oc1cc(ccc1C(=O)NS(=O)(=O)c1ccc(NCC2CCOCC2)c(c1)[N+]([O-])=O)N1CCN(Cc2ccccc2-c2ccc(Cl)cc2)CC1
BDBM144905 CN(C)CCc1ccc(Oc2cc(ccc2C(=O)NS(=O)(=O)c2ccc(NCC3CCOCC3)c(c2)[N+]([O-])=O)N2CCN(Cc3ccccc3-c3ccc(Cl)cc3)CC2)cc1
BDBM144906 [O-][N+](=O)c1cc(ccc1NCC1CCOCC1)S(=O)(=O)NC(=O)c1ccc(cc1Oc1ccc(OCc2ccccc2)cc1)N1CCN(Cc2ccccc2-c2ccc(Cl)cc2)CC1
BDBM144907 [O-][N+](=O)c1cc(ccc1NCC1CCOCC1)S(=O)(=O)NC(=O)c1ccc(cc1Oc1cccc(c1)N1CCOCC1)N1CCN(Cc2ccccc2-c2ccc(Cl)cc2)CC1
BDBM144908 Cc1nc2cc(Oc3cc(ccc3C(=O)NS(=O)(=O)c3ccc(NCC4CCOCC4)c(c3)[N+]([O-])=O)N3CCN(Cc4ccccc4-c4ccc(Cl)cc4)CC3)ccc2s1
BDBM144966 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(NCCCN4CCOCC4)c(c3)[N+]([O-])=O)c(Oc3cccc(Cl)c3F)c2)=C(C1)c1ccc(Cl)cc1 |c:57|
BDBM144967 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(NCCN4CCOCC4)c(c3)[N+]([O-])=O)c(Oc3cccc(Cl)c3F)c2)=C(C1)c1ccc(Cl)cc1 |c:56|
BDBM144968 CN1CCC(CC1)Nc1ccc(cc1[N+]([O-])=O)S(=O)(=O)NC(=O)c1ccc(cc1Oc1c(F)cccc1Cl)N1CCN(CC2=C(CC(C)(C)CC2)c2ccc(Cl)cc2)CC1 |t:47|
BDBM144969 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(NC4CCN(CC4)C4CCOCC4)c(c3)[N+]([O-])=O)c(Oc3c(F)cccc3Cl)c2)=C(C1)c1ccc(Cl)cc1 |c:61|
BDBM145034 CN1CCC(CC1)Nc1ccc(cc1[N+]([O-])=O)S(=O)(=O)NC(=O)c1ccc(cc1OCc1csc(NC(=O)OC(C)(C)C)n1)N1CCN(CC2=C(CC(C)(C)CC2)c2ccc(Cl)cc2)CC1 |t:53|
BDBM145035 CN1CCC(CC1)Nc1ccc(cc1[N+]([O-])=O)S(=O)(=O)NC(=O)c1ccc(cc1OCc1csc(N)n1)N1CCN(CC2=C(CC(C)(C)CC2)c2ccc(Cl)cc2)CC1 |t:46|
BDBM145036 CN1CCC(CC1)Nc1ccc(cc1[N+]([O-])=O)S(=O)(=O)NC(=O)c1ccc(cc1Oc1cccc(NC(C)=O)c1)N1CCN(CC2=C(CC(C)(C)CC2)c2ccc(Cl)cc2)CC1 |t:49|
BDBM145082 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(NCC4CCOCC4)c(c3)[N+]([O-])=O)c(Oc3ccc(N)nc3)c2)=C(C1)c1ccc(Cl)cc1 |c:54|
BDBM145083 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(NC4CCN(CC4)C4CCOCC4)c(c3)[N+]([O-])=O)c(Oc3ccnc(N)c3)c2)=C(C1)c1ccc(Cl)cc1 |c:60|
BDBM145084 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(NCC4CCOCC4)c(c3)[N+]([O-])=O)c(Oc3cncc(Br)c3)c2)=C(C1)c1ccc(Cl)cc1 |c:54|
BDBM144849 CN(C)Cc1ccccc1Oc1cc(ccc1C(=O)NS(=O)(=O)c1ccc(NCC2CCOCC2)c(c1)[N+]([O-])=O)N1CCN(Cc2ccccc2-c2ccc(Cl)cc2)CC1
BDBM144850 CN(C)CCCNc1ccc(cc1[N+]([O-])=O)S(=O)(=O)NC(=O)c1ccc(cc1Oc1cccc(c1)N1CCOCC1)N1CCN(Cc2ccccc2-c2ccc(Cl)cc2)CC1
BDBM144851 Cc1nc(C)c(s1)-c1cccc(Oc2cc(ccc2C(=O)NS(=O)(=O)c2ccc(NCCCN3CCOCC3)c(c2)[N+]([O-])=O)N2CCN(Cc3ccccc3-c3ccc(Cl)cc3)CC2)c1
BDBM144909 CC(C)(C)OC(=O)N1CCN(CC1)c1cccc(Oc2cc(ccc2C(=O)NS(=O)(=O)c2ccc(NCC3CCOCC3)c(c2)[N+]([O-])=O)N2CCN(Cc3ccccc3-c3ccc(Cl)cc3)CC2)c1
BDBM144910 CN(C)CCCNc1ccc(cc1[N+]([O-])=O)S(=O)(=O)NC(=O)c1ccc(cc1Oc1cccc(OCc2ccccc2)c1)N1CCN(Cc2ccccc2-c2ccc(Cl)cc2)CC1
BDBM144911 [O-][N+](=O)c1cc(ccc1NCCCN1CCOCC1)S(=O)(=O)NC(=O)c1ccc(cc1Oc1cccc(OCc2ccccc2)c1)N1CCN(Cc2ccccc2-c2ccc(Cl)cc2)CC1
BDBM144970 CN1CCC(CC1)Nc1ccc(cc1[N+]([O-])=O)S(=O)(=O)NC(=O)c1ccc(cc1Oc1cc2cc[nH]c2cc1F)N1CCN(CC2=C(CC(C)(C)CC2)c2ccc(Cl)cc2)CC1 |t:50|
BDBM144971 CN1CCC(CNc2ccc(cc2[N+]([O-])=O)S(=O)(=O)NC(=O)c2ccc(cc2Oc2cccc(Cl)c2)N2CCN(CC3=C(CC(C)(C)CC3)c3ccc(Cl)cc3)CC2)CC1 |t:44|
BDBM144972 CN1CCC(CNc2ccc(cc2[N+]([O-])=O)S(=O)(=O)NC(=O)c2ccc(cc2Oc2cccc(F)c2F)N2CCN(CC3=C(CC(C)(C)CC3)c3ccc(Cl)cc3)CC2)CC1 |t:45|
BDBM145037 CC(=O)Nc1cccc(Oc2cc(ccc2C(=O)NS(=O)(=O)c2ccc(NC3CCN(CC3)C3CCOCC3)c(c2)[N+]([O-])=O)N2CCN(CC3=C(CC(C)(C)CC3)c3ccc(Cl)cc3)CC2)c1 |t:53|
BDBM145038 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(NC4CCN(CC4)C4CCOCC4)c(c3)[N+]([O-])=O)c(Nc3ccccc3Cl)c2)=C(C1)c1ccc(Cl)cc1 |c:60|
BDBM145039 COc1cc2[nH]ccc2cc1Oc1cc(ccc1C(=O)NS(=O)(=O)c1ccc(NC2CCN(CC2)C2CCOCC2)c(c1)[N+]([O-])=O)N1CCN(CC2=C(CC(C)(C)CC2)c2ccc(Cl)cc2)CC1 |t:57|
BDBM145085 CC1(C)CC(=C(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(NCC4CCOCC4)c(c3)[N+]([O-])=O)c(Oc3cc4cc[nH]c4cc3Cl)c2)CO1)c1ccc(Cl)cc1 |t:4|
BDBM145086 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(NCC4CCOCC4)c(c3)[N+]([O-])=O)c(Oc3cc4cc[nH]c4cc3Cl)c2)=C(C1)c1ccc(Cl)cc1 |c:58|
BDBM145087 CC1(C)CC(=C(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(NCC4CCOCC4)c(c3)[N+]([O-])=O)c(Oc3cc4cc[nH]c4cc3F)c2)CO1)c1ccc(Cl)cc1 |t:4|
BDBM161574 Cc1c(cc(-c2cc(Cl)ccc2C(=O)N2Cc3ccccc3C[C@H]2CN2CCOCC2)n1C)C(=O)N(c1ccc(O)cc1)c1cc2ccn(C)c2cn1
BDBM144853 CN1CCC(CC1)Nc1ccc(cc1[N+]([O-])=O)S(=O)(=O)NC(=O)c1ccc(cc1Oc1cc(Cl)cc(Cl)c1)N1CCN(CC2=C(CC(C)(C)CC2)c2ccc(Cl)cc2)CC1 |t:47|
BDBM144854 CN1CCC(CC1)Nc1ccc(cc1[N+]([O-])=O)S(=O)(=O)NC(=O)c1ccc(cc1Oc1cccc(Cl)c1)N1CCN(CC2=C(CC(C)(C)CC2)c2ccc(Cl)cc2)CC1 |t:46|
BDBM144855 CN(C)CCOc1ccc(c(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(NC4CCN(C)CC4)c(c3)[N+]([O-])=O)c(Oc3cccc(Cl)c3)c2)c1)-c1ccc(Cl)cc1
BDBM144856 CN1CCC(CC1)Nc1ccc(cc1[N+]([O-])=O)S(=O)(=O)NC(=O)c1ccc(cc1Oc1ccccc1Cl)N1CCN(CC2=C(CC(C)(C)OC2)c2ccc(Cl)cc2)CC1 |t:46|
BDBM144912 [O-][N+](=O)c1cc(ccc1NCC1CCOCC1)S(=O)(=O)NC(=O)c1ccc(cc1Oc1ccc(OCCN2CCOCC2)cc1)N1CCN(Cc2ccccc2-c2ccc(Cl)cc2)CC1
BDBM144913 [O-][N+](=O)c1cc(ccc1NCC1CCOCC1)S(=O)(=O)NC(=O)c1ccc(cc1Oc1cccc2NC(=O)CCc12)N1CCN(Cc2ccccc2-c2ccc(Cl)cc2)CC1
BDBM144914 [O-][N+](=O)c1cc(ccc1NCCCN1CCOCC1)S(=O)(=O)NC(=O)c1ccc(cc1Oc1ccc(OCc2ccccc2)cc1)N1CCN(Cc2ccccc2-c2ccc(Cl)cc2)CC1
BDBM144973 CN1CCC(CC1)Nc1ccc(cc1[N+]([O-])=O)S(=O)(=O)NC(=O)c1ccc(cc1Oc1ccc2[nH]ccc2c1F)N1CCN(CC2=C(CC(C)(C)CC2)c2ccc(Cl)cc2)CC1 |t:50|
BDBM144974 COCOc1cccc(Oc2cc(ccc2C(=O)NS(=O)(=O)c2ccc(NC3CCN(C)CC3)c(c2)[N+]([O-])=O)N2CCN(CC3=C(CC(C)(C)CC3)c3ccc(Cl)cc3)CC2)c1C |t:47|
BDBM144975 CN1CCC(CC1)Nc1ccc(cc1[N+]([O-])=O)S(=O)(=O)NC(=O)c1ccc(cc1Oc1cccc(Br)c1)N1CCN(CC2=C(CC(C)(C)OC2)c2ccc(Cl)cc2)CC1 |t:46|
BDBM144976 CN1CCC(CC1)Nc1ccc(cc1[N+]([O-])=O)S(=O)(=O)NC(=O)c1ccc(cc1Oc1cccc(I)c1)N1CCN(CC2=C(CC(C)(C)OC2)c2ccc(Cl)cc2)CC1 |t:46|
BDBM145040 CN1CCC(CC1)Nc1ccc(cc1[N+]([O-])=O)S(=O)(=O)NC(=O)c1ccc(cc1Oc1ccc2nc(N)sc2c1)N1CCN(CC2=C(CC(C)(C)CC2)c2ccc(Cl)cc2)CC1 |t:50|
BDBM145041 CN1CCC(CC1)Nc1ccc(cc1[N+]([O-])=O)S(=O)(=O)NC(=O)c1ccc(cc1Nc1ccccc1Cl)N1CCN(CC2=C(CC(C)(C)CC2)c2ccc(Cl)cc2)CC1 |t:46|
BDBM145042 CN(C)CCCNc1ccc(cc1[N+]([O-])=O)S(=O)(=O)NC(=O)c1ccc(cc1Oc1ccc2n(ccc2c1)C(=O)OC(C)(C)C)N1CCN(CC2=C(CC(C)(C)CC2)c2ccc(Cl)cc2)CC1 |t:54|
BDBM145088 CC(C)(C)OC(=O)Nc1cncc(Oc2cc(ccc2C(=O)NS(=O)(=O)c2ccc(NCC3CCOCC3)c(c2)[N+]([O-])=O)N2CCN(CC3=C(CC(C)(C)CC3)c3ccc(Cl)cc3)CC2)c1 |t:51|
BDBM145089 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(NCC4CCOCC4)c(c3)[N+]([O-])=O)c(Oc3cncc(N)c3)c2)=C(C1)c1ccc(Cl)cc1 |c:54|
BDBM145090 CC(C)(C)OC(=O)Nc1cc(Oc2cc(ccc2C(=O)NS(=O)(=O)c2ccc(NCC3CCOCC3)c(c2)[N+]([O-])=O)N2CCN(CC3=C(CC(C)(C)CC3)c3ccc(Cl)cc3)CC2)ccn1 |t:49|
BDBM144857 CN(C)CCOc1cccc(Oc2cc(ccc2C(=O)NS(=O)(=O)c2ccc(NCC3CCOCC3)c(c2)[N+]([O-])=O)N2CCN(Cc3ccccc3-c3ccc(Cl)cc3)CC2)c1
BDBM144858 CN1CCC(CC1)Nc1ccc(cc1[N+]([O-])=O)S(=O)(=O)NC(=O)c1ccc(cc1Oc1ccc(N)c(Cl)c1)N1CCN(CC2=C(CC(C)(C)CC2)c2ccc(Cl)cc2)CC1 |t:47|
BDBM144859 CC(C)N1CCC(CC1)Nc1ccc(cc1[N+]([O-])=O)S(=O)(=O)NC(=O)c1ccc(cc1Oc1ccccc1Cl)N1CCN(CC2=C(CC(C)(C)CC2)c2ccc(Cl)cc2)CC1 |t:48|
BDBM144860 CN1CCC(CC1)Nc1ccc(cc1[N+]([O-])=O)S(=O)(=O)NC(=O)c1ccc(cc1Oc1ccccc1Br)N1CCN(CC2=C(CC(C)(C)CC2)c2ccc(Cl)cc2)CC1 |t:46|
BDBM144915 CC(C)(C)OC(=O)N1CCN(CC1)c1ccc(Oc2cc(ccc2C(=O)NS(=O)(=O)c2ccc(NCCCN3CCOCC3)c(c2)[N+]([O-])=O)N2CCN(Cc3ccccc3-c3ccc(Cl)cc3)CC2)cc1
BDBM144916 [O-][N+](=O)c1cc(ccc1NCCCN1CCOCC1)S(=O)(=O)NC(=O)c1ccc(cc1Oc1cccc(c1)-c1ccncc1)N1CCN(Cc2ccccc2-c2ccc(Cl)cc2)CC1
BDBM144917 [O-][N+](=O)c1cc(ccc1NCCCN1CCOCC1)S(=O)(=O)NC(=O)c1ccc(cc1Oc1ccc(cc1)-c1ccncc1)N1CCN(Cc2ccccc2-c2ccc(Cl)cc2)CC1
BDBM144977 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(NC4CCN(CCO)CC4)c(c3)[N+]([O-])=O)c(Oc3cccc(Cl)c3)c2)=C(C1)c1ccc(Cl)cc1 |c:56|
BDBM144978 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(NC4CCN(CCc5ccccc5)CC4)c(c3)[N+]([O-])=O)c(Oc3cccc(Cl)c3)c2)=C(C1)c1ccc(Cl)cc1 |c:62|
BDBM144979 CN1CCC(CC1)Nc1ccc(cc1[N+]([O-])=O)S(=O)(=O)NC(=O)c1ccc(cc1Oc1ccc(Cl)c(Cl)c1)N1CCN(CC2=C(CC(C)(C)CC2)c2ccc(Cl)cc2)CC1 |t:47|
BDBM144980 CN1CCC(CC1)Nc1ccc(cc1[N+]([O-])=O)S(=O)(=O)NC(=O)c1ccc(cc1Oc1cc(F)cc(F)c1Cl)N1CCN(CC2=C(CC(C)(C)CC2)c2ccc(Cl)cc2)CC1 |t:48|
BDBM145043 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(NC4CCN(CC4)C4CCOCC4)c(c3)[N+]([O-])=O)c(Oc3ccc4nc(N)sc4c3)c2)=C(C1)c1ccc(Cl)cc1 |c:64|
BDBM145044 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(NCCCN4CCNC(=O)C4)c(c3)[N+]([O-])=O)c(Oc3cc4cc[nH]c4cc3F)c2)=C(C1)c1ccc(Cl)cc1 |c:61|
BDBM145045 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(NC4CCC(CC4)N4CCOCC4)c(c3)[N+]([O-])=O)c(Oc3cc4cc[nH]c4cc3F)c2)=C(C1)c1ccc(Cl)cc1 |c:64,(-1.64,-14.42,;-.82,-13.11,;-2.36,-13.17,;-.82,-11.57,;.51,-10.8,;1.84,-11.57,;3.18,-10.8,;3.18,-9.26,;4.51,-8.49,;4.51,-6.95,;3.18,-6.18,;1.84,-6.95,;1.84,-8.49,;3.18,-4.64,;4.51,-3.87,;4.51,-2.33,;3.18,-1.56,;3.18,-.02,;1.84,.75,;4.51,.75,;4.51,2.29,;6.05,2.29,;2.97,2.29,;4.51,3.83,;5.84,4.6,;5.84,6.14,;4.51,6.91,;4.51,8.45,;5.84,9.22,;5.84,10.76,;7.18,11.53,;8.51,10.76,;8.51,9.22,;7.18,8.45,;9.84,11.53,;9.84,13.07,;11.18,13.84,;12.51,13.07,;12.51,11.53,;11.18,10.76,;3.18,6.14,;3.18,4.6,;1.84,6.91,;.51,6.14,;1.84,8.45,;1.84,-2.33,;.51,-1.56,;-.82,-2.33,;-2.16,-1.56,;-3.49,-2.33,;-4.96,-1.86,;-5.86,-3.1,;-4.96,-4.35,;-3.49,-3.87,;-2.16,-4.64,;-.82,-3.87,;.51,-4.64,;1.84,-3.87,;1.84,-13.11,;.51,-13.88,;3.18,-13.88,;4.51,-13.11,;5.84,-13.88,;5.84,-15.42,;7.18,-16.19,;4.51,-16.19,;3.18,-15.42,)|
BDBM145091 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(NC4CCN(CC4)C4CCOCC4)c(c3)[N+]([O-])=O)c(Oc3ccc4[nH]cc(Cl)c4c3)c2)=C(C1)c1ccc(Cl)cc1 |c:64|
BDBM145092 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(NCC4CCOCC4)c(c3)[N+]([O-])=O)c(Oc3ccnc(N)c3)c2)=C(C1)c1ccc(Cl)cc1 |c:54|
BDBM145093 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(NCC4CCOCC4)c(c3)[N+]([O-])=O)c(Oc3ccc(O)nc3)c2)=C(C1)c1ccc(Cl)cc1 |c:54|
BDBM144861 CN1CCC(CC1)Nc1ccc(cc1[N+]([O-])=O)S(=O)(=O)NC(=O)c1ccc(cc1Oc1ccccc1Cl)N1CCN(CC2=C(CCCC2)c2ccc(Cl)cc2)CC1 |t:46|
BDBM144862 Cc1n[nH]c2cccc(Oc3cc(ccc3C(=O)NS(=O)(=O)c3ccc(NCCCN4CCOCC4)c(c3)[N+]([O-])=O)N3CCN(CC4=C(CC(C)(C)CC4)c4ccc(Cl)cc4)CC3)c12 |t:49|
BDBM144863 CN1CCC(CC1)Nc1ccc(cc1[N+]([O-])=O)S(=O)(=O)NC(=O)c1ccc(cc1Oc1cccc(F)c1F)N1CCN(CC2=C(CC(C)(C)CC2)c2ccc(Cl)cc2)CC1 |t:47|
BDBM144864 CN1CCC(CC1)Nc1ccc(cc1[N+]([O-])=O)S(=O)(=O)NC(=O)c1ccc(cc1Oc1cccc(Br)c1)N1CCN(CC2=C(CC(C)(C)CC2)c2ccc(Cl)cc2)CC1 |t:46|
BDBM144918 [O-][N+](=O)c1cc(ccc1NCCCN1CCOCC1)S(=O)(=O)NC(=O)c1ccc(cc1Oc1ccc(cc1)-c1cccnc1)N1CCN(Cc2ccccc2-c2ccc(Cl)cc2)CC1
BDBM144919 CN(C)C(=O)COc1ccc(Oc2cc(ccc2C(=O)NS(=O)(=O)c2ccc(NCC3CCOCC3)c(c2)[N+]([O-])=O)N2CCN(Cc3ccccc3-c3ccc(Cl)cc3)CC2)cc1
BDBM144920 Cn1cnc2cc(Oc3cc(ccc3C(=O)NS(=O)(=O)c3ccc(NCCCN4CCOCC4)c(c3)[N+]([O-])=O)N3CCN(Cc4ccccc4-c4ccc(Cl)cc4)CC3)ccc12
BDBM144921 CNC(=O)c1cccc(Oc2cc(ccc2C(=O)NS(=O)(=O)c2ccc(NCCCN3CCOCC3)c(c2)[N+]([O-])=O)N2CCN(Cc3ccccc3-c3ccc(Cl)cc3)CC2)c1
BDBM144981 COc1cccc(Oc2cc(ccc2C(=O)NS(=O)(=O)c2ccc(NC3CCN(C)CC3)c(c2)[N+]([O-])=O)N2CCN(CC3=C(CC(C)(C)CC3)c3ccc(Cl)cc3)CC2)c1 |t:45|
BDBM144982 CN1CCC(CC1)Nc1ccc(cc1[N+]([O-])=O)S(=O)(=O)NC(=O)c1ccc(cc1Oc1cccc(CO)c1)N1CCN(CC2=C(CC(C)(C)CC2)c2ccc(Cl)cc2)CC1 |t:47|
BDBM144983 CN1CCC(C)(CC1)Nc1ccc(cc1[N+]([O-])=O)S(=O)(=O)NC(=O)c1ccc(cc1Oc1cccc(Cl)c1)N1CCN(CC2=C(CC(C)(C)CC2)c2ccc(Cl)cc2)CC1 |t:47|
BDBM144984 COCCOCCN1CCC(CC1)Nc1ccc(cc1[N+]([O-])=O)S(=O)(=O)NC(=O)c1ccc(cc1Oc1cccc(Cl)c1)N1CCN(CC2=C(CC(C)(C)CC2)c2ccc(Cl)cc2)CC1 |t:52|
BDBM145046 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(NC4CCC(CC4)N4CCOCC4)c(c3)[N+]([O-])=O)c(Oc3cc4cc[nH]c4c(F)c3F)c2)=C(C1)c1ccc(Cl)cc1 |c:65,(-1.54,-14.39,;-.72,-13.09,;-2.26,-13.14,;-.72,-11.55,;.61,-10.78,;1.95,-11.55,;3.28,-10.78,;3.28,-9.24,;4.61,-8.47,;4.61,-6.93,;3.28,-6.16,;1.95,-6.93,;1.95,-8.47,;3.28,-4.62,;4.61,-3.85,;4.61,-2.31,;3.28,-1.54,;3.28,0,;1.95,.77,;4.61,.77,;4.61,2.31,;6.15,2.31,;3.07,2.31,;4.61,3.85,;5.95,4.62,;5.95,6.16,;4.61,6.93,;4.61,8.47,;5.95,9.24,;5.95,10.78,;7.28,11.55,;8.62,10.78,;8.62,9.24,;7.28,8.47,;9.95,11.55,;9.95,13.09,;11.28,13.86,;12.62,13.09,;12.62,11.55,;11.28,10.78,;3.28,6.16,;3.28,4.62,;1.95,6.93,;.61,6.16,;1.95,8.47,;1.95,-2.31,;.61,-1.54,;-.72,-2.31,;-2.05,-1.54,;-3.39,-2.31,;-4.85,-1.83,;-5.76,-3.08,;-4.85,-4.32,;-3.39,-3.85,;-2.05,-4.62,;-2.05,-6.16,;-.72,-3.85,;.61,-4.62,;1.95,-3.85,;1.95,-13.09,;.61,-13.86,;3.28,-13.86,;4.61,-13.09,;5.95,-13.86,;5.95,-15.4,;7.28,-16.17,;4.61,-16.17,;3.28,-15.4,)|
BDBM145047 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(NC4CCN(CC5CC5)CC4)c(c3)[N+]([O-])=O)c(Oc3cc4cc[nH]c4cc3F)c2)=C(C1)c1ccc(Cl)cc1 |c:62|
BDBM145048 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(NC4CCN(CC5CC5)CC4)c(c3)[N+]([O-])=O)c(Oc3cc4cc[nH]c4c(F)c3F)c2)=C(C1)c1ccc(Cl)cc1 |c:63|
BDBM145094 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(NCC4CCOCC4)c(c3)[N+]([O-])=O)c(Oc3ccc(OCc4ccccc4)nc3)c2)=C(C1)c1ccc(Cl)cc1 |c:62|
BDBM145095 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(OCC4COCCO4)c(c3)[N+]([O-])=O)c(Oc3cc4cc[nH]c4cc3F)c2)=C(C1)c1ccc(Cl)cc1 |c:58|
BDBM145096 CN1CCN(CC1)Nc1ccc(cc1[N+]([O-])=O)S(=O)(=O)NC(=O)c1ccc(cc1Oc1cccc2[nH]cc(Cl)c12)N1CCN(CC2=C(CC(C)(C)CC2)c2ccc(Cl)cc2)CC1 |t:50|
BDBM144865 CCN1CCC(CC1)Nc1ccc(cc1[N+]([O-])=O)S(=O)(=O)NC(=O)c1ccc(cc1Oc1ccccc1Cl)N1CCN(CC2=C(CC(C)(C)CC2)c2ccc(Cl)cc2)CC1 |t:47|
BDBM144866 CN1C(C)(C)CC(CC1(C)C)Nc1ccc(cc1[N+]([O-])=O)S(=O)(=O)NC(=O)c1ccc(cc1Oc1ccccc1Cl)N1CCN(CC2=C(CC(C)(C)CC2)c2ccc(Cl)cc2)CC1 |t:50|
BDBM144867 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(NC4CCN(CC4)C4CCOCC4)c(c3)[N+]([O-])=O)c(Oc3cccc(F)c3F)c2)=C(C1)c1ccc(Cl)cc1 |c:61|
BDBM144922 CNC(=O)c1cccc(Oc2cc(ccc2C(=O)NS(=O)(=O)c2ccc(NCCCN(C)C)c(c2)[N+]([O-])=O)N2CCN(Cc3ccccc3-c3ccc(Cl)cc3)CC2)c1
BDBM144923 CN(C)C(=O)COc1cccc(Oc2cc(ccc2C(=O)NS(=O)(=O)c2ccc(NCC3CCOCC3)c(c2)[N+]([O-])=O)N2CCN(Cc3ccccc3-c3ccc(Cl)cc3)CC2)c1
BDBM144924 CN(C)CCCc1c[nH]c2ccc(Oc3cc(ccc3C(=O)NS(=O)(=O)c3ccc(NCC4CCOCC4)c(c3)[N+]([O-])=O)N3CCN(Cc4ccccc4-c4ccc(Cl)cc4)CC3)cc12
BDBM144925 CN(C)CCCNc1ccc(cc1[N+]([O-])=O)S(=O)(=O)NC(=O)c1ccc(cc1Oc1cccc(CO)c1)N1CCN(Cc2ccccc2-c2ccc(Cl)cc2)CC1
BDBM144985 CN1CCC(CC1)Nc1ccc(cc1[N+]([O-])=O)S(=O)(=O)NC(=O)c1ccc(cc1Oc1cccc(O)c1Cl)N1CCN(CC2=C(CC(C)(C)CC2)c2ccc(Cl)cc2)CC1 |t:47|
BDBM144986 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(NC4CCN(CCCc5ccccc5)CC4)c(c3)[N+]([O-])=O)c(Oc3cccc(Cl)c3)c2)=C(C1)c1ccc(Cl)cc1 |c:63|
BDBM144987 COCCN1CCC(CC1)Nc1ccc(cc1[N+]([O-])=O)S(=O)(=O)NC(=O)c1ccc(cc1Oc1cccc(Cl)c1)N1CCN(CC2=C(CC(C)(C)CC2)c2ccc(Cl)cc2)CC1 |t:49|
BDBM144988 CCN1CCC(CC1)Nc1ccc(cc1[N+]([O-])=O)S(=O)(=O)NC(=O)c1ccc(cc1Oc1cccc(Cl)c1)N1CCN(CC2=C(CC(C)(C)CC2)c2ccc(Cl)cc2)CC1 |t:47|
BDBM145049 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(NCC4CCOCC4)c(c3)[N+]([O-])=O)c(Oc3cc4cc[nH]c4cc3F)c2)=C(C1)c1ccc(Cl)cc1 |c:58|
BDBM145050 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(NCCCN4CCNC(=O)C4)c(c3)[N+]([O-])=O)c(Oc3cc4cc[nH]c4c(F)c3F)c2)=C(C1)c1ccc(Cl)cc1 |c:62|
BDBM145051 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(NC(CO)C4CCOCC4)c(c3)[N+]([O-])=O)c(Oc3cc4cc[nH]c4cc3F)c2)=C(C1)c1ccc(Cl)cc1 |c:60|
BDBM145097 CN1CCN(CC1)Nc1ccc(cc1[N+]([O-])=O)S(=O)(=O)NC(=O)c1ccc(cc1Oc1cccc2NC(=O)Cc12)N1CCN(CC2=C(CC(C)(C)CC2)c2ccc(Cl)cc2)CC1 |t:50|
BDBM145098 CN1CCC(CC1)Nc1ccc(cc1[N+]([O-])=O)S(=O)(=O)NC(=O)c1ccc(cc1Oc1cccc2NC(=O)Cc12)N1CCN(CC2=C(CC(C)(C)CC2)c2ccc(Cl)cc2)CC1 |t:50|
BDBM145099 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(NC4CCN(CC4)C4CCOCC4)c(c3)[N+]([O-])=O)c(Oc3cccc4NC(=O)Cc34)c2)=C(C1)c1ccc(Cl)cc1 |c:64|
BDBM161602 Cc1c(cc(-c2cc(F)ccc2C(=O)N2Cc3ccccc3C[C@H]2CN2CCOCC2)n1C)C(=O)N(c1ccc(O)cc1)c1cccc(c1)C#N
BDBM144868 CN1CCC(CC1)Nc1ccc(cc1[N+]([O-])=O)S(=O)(=O)NC(=O)c1ccc(cc1Oc1cc(F)c2[nH]ccc2c1)N1CCN(CC2=C(CC(C)(C)CC2)c2ccc(Cl)cc2)CC1 |t:50|
BDBM144869 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(NCCCN4CCOCC4)c(c3)[N+]([O-])=O)c(Oc3cccc(F)c3F)c2)=C(C1)c1ccc(Cl)cc1 |c:57|
BDBM144870 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(NCCCN4CCOCC4)c(c3)[N+]([O-])=O)c(Oc3ccc(N)c(Cl)c3)c2)=C(C1)c1ccc(Cl)cc1 |c:57|
BDBM144927 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(NCC4(N)CCOCC4)c(c3)[N+]([O-])=O)c(Oc3cccc(Cl)c3)c2)=C(C1)c1ccc(Cl)cc1 |c:55|
BDBM144928 CC(N1CCN(CC1)c1ccc(C(=O)NS(=O)(=O)c2ccc(NCC3CCOCC3)c(c2)[N+]([O-])=O)c(Oc2ccccc2Cl)c1)c1ccccc1-c1ccc(Cl)cc1
BDBM144929 CN1CCC(CC1)Nc1ccc(cc1[N+]([O-])=O)C(=O)NS(=O)(=O)c1ccc(cc1Oc1cc(Cl)cc(Cl)c1)N1CCN(Cc2ccccc2-c2ccc(Cl)cc2)CC1
BDBM144989 CC(C)N1CCC(CC1)Nc1ccc(cc1[N+]([O-])=O)S(=O)(=O)NC(=O)c1ccc(cc1Oc1cccc(Cl)c1)N1CCN(CC2=C(CC(C)(C)CC2)c2ccc(Cl)cc2)CC1 |t:48|
BDBM144990 CN1CCC(CC1)Nc1ccc(cc1[N+]([O-])=O)S(=O)(=O)NC(=O)c1ccc(cc1Oc1cccc(O)c1)N1CCN(CC2=C(CC(C)(C)CC2)c2ccc(Cl)cc2)CC1 |t:46|
BDBM144991 CN1CCC(CC1)Nc1ccc(cc1[N+]([O-])=O)S(=O)(=O)NC(=O)c1ccc(cc1Oc1cccc(F)c1Cl)N1CCN(CC2=C(CC(C)(C)CC2)c2ccc(Cl)cc2)CC1 |t:47|
BDBM144992 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(NC4CCN(CC4)C4CCOCC4)c(c3)[N+]([O-])=O)c(Oc3cccc(F)c3Cl)c2)=C(C1)c1ccc(Cl)cc1 |c:61|
BDBM145052 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(NCC4(CO)CCOCC4)c(c3)[N+]([O-])=O)c(Oc3cc4cc[nH]c4cc3F)c2)=C(C1)c1ccc(Cl)cc1 |c:60|
BDBM145053 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(NC4CCN(CC4)C4CCOCC4)c(c3)[N+]([O-])=O)c(Oc3cc4cc[nH]c4cc3Cl)c2)=C(C1)c1ccc(Cl)cc1 |c:64|
BDBM145054 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(NCC4CCOCC4)c(c3)[N+]([O-])=O)c(Oc3cc4cc[nH]c4c(F)c3F)c2)=C(C1)c1ccc(Cl)cc1 |c:59|
BDBM145100 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(OCC4COCCO4)c(c3)[N+]([O-])=O)c(Oc3cc4cc[nH]c4cc3Cl)c2)=C(C1)c1ccc(Cl)cc1 |c:58|
BDBM145101 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(NCC4COCCO4)c(c3)[N+]([O-])=O)c(Oc3cc4cc[nH]c4cc3Cl)c2)=C(C1)c1ccc(Cl)cc1 |c:58|
BDBM145102 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(NCC4COCCO4)c(c3)[N+]([O-])=O)c(Oc3cc4cc[nH]c4cc3F)c2)=C(C1)c1ccc(Cl)cc1 |c:58|
BDBM144871 [O-][N+](=O)c1cc(ccc1NCC1CCOCC1)S(=O)(=O)NC(=O)c1ccc(cc1Oc1cccc(Cl)c1)N1CCN(Cc2cc(CCN3CCCC3)ccc2-c2ccc(Cl)cc2)CC1
BDBM144872 CN1CCC(CC1)Nc1ccc(cc1[N+]([O-])=O)S(=O)(=O)NC(=O)c1ccc(cc1Oc1cccc(Cl)c1Cl)N1CCN(CC2=C(CC(C)(C)CC2)c2ccc(Cl)cc2)CC1 |t:47|
BDBM144873 CN1CCC(CC1)Nc1ccc(cc1[N+]([O-])=O)S(=O)(=O)NC(=O)c1ccc(cc1Oc1cccc2[nH]nc(C)c12)N1CCN(CC2=C(CC(C)(C)CC2)c2ccc(Cl)cc2)CC1 |t:50|
BDBM144874 CN1CCC(CC1)Nc1ccc(cc1[N+]([O-])=O)S(=O)(=O)NC(=O)c1ccc(cc1Oc1ccccc1Cl)N1CCN(CC2=C(CCCCC2)c2ccc(Cl)cc2)CC1 |t:46|
BDBM144930 CN1CCC(CC1)Nc1ccc(cc1[N+]([O-])=O)S(=O)(=O)NC(=O)c1ccc(cc1Oc1cccc(F)c1)N1CCN(CC2=C(CC(C)(C)CC2)c2ccc(Cl)cc2)CC1 |t:46|
BDBM144931 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(NC4CCN(CC4)C4CCOCC4)c(c3)[N+]([O-])=O)c(Oc3cccc(F)c3)c2)=C(C1)c1ccc(Cl)cc1 |c:60|
BDBM144932 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(NCCCN4CCOCC4)c(c3)[N+]([O-])=O)c(Oc3cccc(F)c3)c2)=C(C1)c1ccc(Cl)cc1 |c:56|
BDBM144933 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(NC4CCN(CC4)C4CCOCC4)c(c3)[N+]([O-])=O)c(Oc3ccccc3Cl)c2)=C(C1)c1ccc(Cl)cc1 |c:60|
BDBM144993 CN(C)CCCNc1ccc(cc1[N+]([O-])=O)S(=O)(=O)NC(=O)c1ccc(cc1Oc1ccccc1Cl)N1CCN(CC2=C(CC(C)(C)CC2)c2ccc(Cl)cc2)CC1 |t:44|
BDBM144994 COc1ccccc1Oc1cc(ccc1C(=O)NS(=O)(=O)c1ccc(NC2CCN(C)CC2)c(c1)[N+]([O-])=O)N1CCN(CC2=C(CC(C)(C)CC2)c2ccc(Cl)cc2)CC1 |t:47|
BDBM144995 CN1CCC(CC1)Nc1ccc(cc1[N+]([O-])=O)S(=O)(=O)NC(=O)c1ccc(cc1Oc1ccccc1C)N1CCN(CC2=C(CC(C)(C)CC2)c2ccc(Cl)cc2)CC1 |t:46|
BDBM144996 CN1CCC(CC1)Nc1ccc(cc1[N+]([O-])=O)S(=O)(=O)NC(=O)c1ccc(cc1Oc1cccc(C)c1)N1CCN(CC2=C(CC(C)(C)CC2)c2ccc(Cl)cc2)CC1 |t:46|
BDBM145021 CN1CCN(CC1)Nc1ccc(cc1[N+]([O-])=O)S(=O)(=O)NC(=O)c1ccc(cc1Oc1ccc(O)cc1Cl)N1CCN(CC2=C(CC(C)(C)CC2)c2ccc(Cl)cc2)CC1 |t:47|
BDBM145055 CN1CCN(CC1)Nc1ccc(cc1[N+]([O-])=O)S(=O)(=O)NC(=O)c1ccc(cc1Oc1cc2cc[nH]c2cc1Cl)N1CCN(CC2=C(CC(C)(C)CC2)c2ccc(Cl)cc2)CC1 |t:50|
BDBM145056 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(NC4CCN(Cc5cscn5)CC4)c(c3)[N+]([O-])=O)c(Oc3cc4cc[nH]c4cc3F)c2)=C(C1)c1ccc(Cl)cc1 |c:64|
BDBM145057 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(NCC4CCOCC4)c(c3)[N+]([O-])=O)c(Oc3cccc(Cl)c3)c2)=C(C1)c1ccc(Cl)cc1 |c:54|
BDBM145103 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(NC4CCC(CC4)N4CCOCC4)c(c3)[N+]([O-])=O)c(Oc3cc4cc[nH]c4cc3Cl)c2)=C(C1)c1ccc(Cl)cc1 |c:64,(-1.64,-14.42,;-.82,-13.11,;-2.36,-13.17,;-.82,-11.57,;.51,-10.8,;1.84,-11.57,;3.18,-10.8,;3.18,-9.26,;4.51,-8.49,;4.51,-6.95,;3.18,-6.18,;1.84,-6.95,;1.84,-8.49,;3.18,-4.64,;4.51,-3.87,;4.51,-2.33,;3.18,-1.56,;3.18,-.02,;1.84,.75,;4.51,.75,;4.51,2.29,;6.05,2.29,;2.97,2.29,;4.51,3.83,;5.84,4.6,;5.84,6.14,;4.51,6.91,;4.51,8.45,;5.84,9.22,;5.84,10.76,;7.18,11.53,;8.51,10.76,;8.51,9.22,;7.18,8.45,;9.84,11.53,;9.84,13.07,;11.18,13.84,;12.51,13.07,;12.51,11.53,;11.18,10.76,;3.18,6.14,;3.18,4.6,;1.84,6.91,;.51,6.14,;1.84,8.45,;1.84,-2.33,;.51,-1.56,;-.82,-2.33,;-2.16,-1.56,;-3.49,-2.33,;-4.96,-1.86,;-5.86,-3.1,;-4.96,-4.35,;-3.49,-3.87,;-2.16,-4.64,;-.82,-3.87,;.51,-4.64,;1.84,-3.87,;1.84,-13.11,;.51,-13.88,;3.18,-13.88,;4.51,-13.11,;5.84,-13.88,;5.84,-15.42,;7.18,-16.19,;4.51,-16.19,;3.18,-15.42,)|
BDBM145104 CC1(C)CC(=C(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(NC4CCC(CC4)N4CCOCC4)c(c3)[N+]([O-])=O)c(Oc3cc4cc[nH]c4cc3Cl)c2)CO1)c1ccc(Cl)cc1 |t:4,(-1.64,-14.42,;-.82,-13.11,;-2.36,-13.17,;.51,-13.88,;1.84,-13.11,;1.84,-11.57,;3.18,-10.8,;3.18,-9.26,;4.51,-8.49,;4.51,-6.95,;3.18,-6.18,;1.84,-6.95,;1.84,-8.49,;3.18,-4.64,;4.51,-3.87,;4.51,-2.33,;3.18,-1.56,;3.18,-.02,;1.84,.75,;4.51,.75,;4.51,2.29,;6.05,2.29,;2.97,2.29,;4.51,3.83,;5.84,4.6,;5.84,6.14,;4.51,6.91,;4.51,8.45,;5.84,9.22,;5.84,10.76,;7.18,11.53,;8.51,10.76,;8.51,9.22,;7.18,8.45,;9.84,11.53,;9.84,13.07,;11.18,13.84,;12.51,13.07,;12.51,11.53,;11.18,10.76,;3.18,6.14,;3.18,4.6,;1.84,6.91,;.51,6.14,;1.84,8.45,;1.84,-2.33,;.51,-1.56,;-.82,-2.33,;-2.16,-1.56,;-3.49,-2.33,;-4.96,-1.86,;-5.86,-3.1,;-4.96,-4.35,;-3.49,-3.87,;-2.16,-4.64,;-.82,-3.87,;.51,-4.64,;1.84,-3.87,;.51,-10.8,;-.82,-11.57,;3.18,-13.88,;4.51,-13.11,;5.84,-13.88,;5.84,-15.42,;7.18,-16.19,;4.51,-16.19,;3.18,-15.42,)|
BDBM144875 CN1CCC(CC1)Nc1ccc(cc1[N+]([O-])=O)S(=O)(=O)NC(=O)c1ccc(cc1Oc1cccc(c1)C(F)(F)F)N1CCN(CC2=C(CC(C)(C)CC2)c2ccc(Cl)cc2)CC1 |t:49|
BDBM144876 CN(C)CCCNc1ccc(cc1[N+]([O-])=O)S(=O)(=O)NC(=O)c1ccc(cc1Oc1cccc2NC(=O)CCc12)N1CCN(Cc2ccccc2-c2ccc(Cl)cc2)CC1
BDBM144877 CN1CCC(CC1)Nc1ccc(cc1S(=O)(=O)C(F)(F)F)S(=O)(=O)NC(=O)c1ccc(cc1Oc1ccccc1Cl)N1CCN(CC2=C(CC(C)(C)CC2)c2ccc(Cl)cc2)CC1 |t:50|
BDBM144878 CN1CCC(CC1)Nc1ccc(cc1[N+]([O-])=O)S(=O)(=O)NC(=O)c1ccc(cc1Oc1cc(Cl)ccc1Cl)N1CCN(CC2=C(CC(C)(C)CC2)c2ccc(Cl)cc2)CC1 |t:47|
BDBM144934 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(NCCCN4CCOCC4)c(c3)[N+]([O-])=O)c(Oc3ccccc3Cl)c2)=C(C1)c1ccc(Cl)cc1 |c:56|
BDBM144935 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(NC4CCN(CC4)C4CCCC4)c(c3)[N+]([O-])=O)c(Oc3ccccc3Cl)c2)=C(C1)c1ccc(Cl)cc1 |c:59|
BDBM144936 CN1CCC(CC1)Nc1ccc(cc1[N+]([O-])=O)S(=O)(=O)NC(=O)c1ccc(cc1Oc1ccc(F)cc1)N1CCN(CC2=C(CC(C)(C)CC2)c2ccc(Cl)cc2)CC1 |t:46|
BDBM144937 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(NC4CCN(CC4)C4CC4)c(c3)[N+]([O-])=O)c(Oc3cccc(Cl)c3)c2)=C(C1)c1ccc(Cl)cc1 |c:57|
BDBM144997 CN1CCC(CC1)Nc1ccc(cc1[N+]([O-])=O)S(=O)(=O)NC(=O)c1ccc(cc1Oc1ccccc1Cl)N1CCN(Cc2cc3OCOc3cc2-c2ccc(Cl)cc2)CC1
BDBM144998 CN1CCN(CC1)Nc1ccc(cc1[N+]([O-])=O)S(=O)(=O)NC(=O)c1ccc(cc1Oc1ccccc1Cl)N1CCN(CC2=C(CC(C)(C)CC2)c2ccc(Cl)cc2)CC1 |t:46|
BDBM144999 CN1CCN(CC1)Nc1ccc(cc1[N+]([O-])=O)S(=O)(=O)NC(=O)c1ccc(cc1Oc1cccc(Cl)c1)N1CCN(CC2=C(CC(C)(C)OC2)c2ccc(Cl)cc2)CC1 |t:46|
BDBM145000 CN1CCN(CC1)Nc1ccc(cc1[N+]([O-])=O)S(=O)(=O)NC(=O)c1ccc(cc1Oc1cccc(F)c1F)N1CCN(CC2=C(CC(C)(C)OC2)c2ccc(Cl)cc2)CC1 |t:47|
BDBM145023 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(NC4CCN(CC4)C4CCOCC4)c(c3)[N+]([O-])=O)c(Oc3cc(F)cc4[nH]ccc34)c2)=C(C1)c1ccc(Cl)cc1 |c:64|
BDBM145022 CN1CCC(CC1)Nc1ccc(cc1[N+]([O-])=O)S(=O)(=O)NC(=O)c1ccc(cc1Oc1cc(F)cc2[nH]ccc12)N1CCN(CC2=C(CC(C)(C)CC2)c2ccc(Cl)cc2)CC1 |t:50|
BDBM145024 CN1CCN(CC1)Nc1ccc(cc1S(=O)(=O)C(F)(F)F)S(=O)(=O)NC(=O)c1ccc(cc1Oc1ccc(O)cc1Cl)N1CCN(CC2=C(CC(C)(C)CC2)c2ccc(Cl)cc2)CC1 |t:51|
BDBM145058 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(NCC4CCOCC4)c(c3)[N+]([O-])=O)c(Oc3ccc(N)c(Cl)c3)c2)=C(C1)c1ccc(Cl)cc1 |c:55|
BDBM145059 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(NCC4(N)CCOCC4)c(c3)[N+]([O-])=O)c(Oc3cc4cc[nH]c4cc3F)c2)=C(C1)c1ccc(Cl)cc1 |c:59|
BDBM145060 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(N[C@@H]4CCN(Cc5cscn5)C[C@@H]4O)c(c3)[N+]([O-])=O)c(Oc3cc4cc[nH]c4cc3F)c2)=C(C1)c1ccc(Cl)cc1 |c:65|
BDBM145105 CC1(C)CC(=C(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(NC4CCC(CC4)N4CCOCC4)c(c3)[N+]([O-])=O)c(Oc3cc4cc[nH]c4cc3F)c2)CO1)c1ccc(Cl)cc1 |t:4,(5.44,-12.62,;6.26,-11.31,;4.72,-11.37,;7.59,-12.08,;8.92,-11.31,;8.92,-9.77,;10.26,-9,;10.26,-7.46,;11.59,-6.69,;11.59,-5.15,;10.26,-4.38,;8.92,-5.15,;8.92,-6.69,;10.26,-2.84,;11.59,-2.07,;11.59,-.53,;10.26,.24,;10.26,1.78,;8.92,2.55,;11.59,2.55,;11.59,4.09,;13.13,4.09,;10.05,4.09,;11.59,5.63,;12.93,6.4,;12.93,7.94,;11.59,8.71,;11.59,10.25,;12.93,11.02,;12.93,12.56,;14.26,13.33,;15.59,12.56,;15.59,11.02,;14.26,10.25,;16.93,13.33,;16.93,14.87,;18.26,15.64,;19.59,14.87,;19.59,13.33,;18.26,12.56,;10.26,7.94,;10.26,6.4,;8.92,8.71,;7.59,7.94,;8.92,10.25,;8.92,-.53,;7.59,.24,;6.26,-.53,;4.92,.24,;3.59,-.53,;2.13,-.06,;1.22,-1.3,;2.13,-2.55,;3.59,-2.07,;4.92,-2.84,;6.26,-2.07,;7.59,-2.84,;8.92,-2.07,;7.59,-9,;6.26,-9.77,;10.26,-12.08,;11.59,-11.31,;12.93,-12.08,;12.93,-13.62,;14.26,-14.39,;11.59,-14.39,;10.26,-13.62,)|
BDBM145106 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(OCC4(F)CCOCC4)c(c3)[N+]([O-])=O)c(Oc3cc4cc[nH]c4cc3F)c2)=C(C1)c1ccc(Cl)cc1 |c:59|
BDBM145107 CC1(C)CC(=C(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3cnc(OCC4CCOCC4)c(c3)C#N)c(Oc3cc4cc[nH]c4cc3F)c2)CO1)c1ccc(Cl)cc1 |t:4|
BDBM144821 CNc1cccc(Oc2cc(ccc2C(=O)NS(=O)(=O)c2ccc(NCC3CCOCC3)c(c2)[N+]([O-])=O)N2CCN(Cc3ccccc3-c3ccc(Cl)cc3)CC2)c1
BDBM144879 CN1CCC(CC1)Nc1ccc(cc1[N+]([O-])=O)S(=O)(=O)NC(=O)c1ccc(cc1Oc1ccc(F)cc1Cl)N1CCN(CC2=C(CC(C)(C)CC2)c2ccc(Cl)cc2)CC1 |t:47|
BDBM144880 CN1CCC(CC1)Nc1ccc(cc1[N+]([O-])=O)S(=O)(=O)NC(=O)c1ccc(cc1Oc1ccccc1Cl)N1CCN(CC2=C(CC(C)(C)C2)c2ccc(Cl)cc2)CC1 |t:46|
BDBM144881 Cc1c[nH]c2cccc(Oc3cc(ccc3C(=O)NS(=O)(=O)c3ccc(NCCCN4CCOCC4)c(c3)[N+]([O-])=O)N3CCN(CC4=C(CC(C)(C)CC4)c4ccc(Cl)cc4)CC3)c12 |t:49|
BDBM144882 CN1CCC(CC1)Nc1ccc(cc1[N+]([O-])=O)S(=O)(=O)NC(=O)c1ccc(cc1Oc1cccc(c1Cl)C(F)(F)F)N1CCN(CC2=C(CC(C)(C)CC2)c2ccc(Cl)cc2)CC1 |t:50|
BDBM144938 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(NCCCN4CCOCC4)c(c3)[N+]([O-])=O)c(Oc3ccc(F)cc3Cl)c2)=C(C1)c1ccc(Cl)cc1 |c:57|
BDBM144939 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(NC4CCN(CC4)C4CC4)c(c3)[N+]([O-])=O)c(Oc3cccc(F)c3F)c2)=C(C1)c1ccc(Cl)cc1 |c:58|
BDBM144940 CN1CCC(CC1)Nc1ccc(cc1[N+]([O-])=O)S(=O)(=O)NC(=O)c1ccc(cc1Oc1ccccc1F)N1CCN(CC2=C(CC(C)(C)CC2)c2ccc(Cl)cc2)CC1 |t:46|
BDBM144941 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(NC4CCN(CC4)C4CC4)c(c3)[N+]([O-])=O)c(Oc3ccccc3F)c2)=C(C1)c1ccc(Cl)cc1 |c:57|
BDBM145001 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(NC4CCN(CC5CC5)CC4)c(c3)[N+]([O-])=O)c(Oc3cccc(Cl)c3)c2)=C(C1)c1ccc(Cl)cc1 |c:58|
BDBM145002 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(NC4CCN(CC5CC5)CC4)c(c3)[N+]([O-])=O)c(Oc3ccccc3Cl)c2)=C(C1)c1ccc(Cl)cc1 |c:58|
BDBM145003 CN(C)C(=O)CN1CCC(CC1)Nc1ccc(cc1[N+]([O-])=O)S(=O)(=O)NC(=O)c1ccc(cc1Oc1cccc(Cl)c1)N1CCN(CC2=C(CC(C)(C)CC2)c2ccc(Cl)cc2)CC1 |t:51|
BDBM145061 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(NCC4(CO)CCOCC4)c(c3)[N+]([O-])=O)c(Oc3ccccc3Cl)c2)=C(C1)c1ccc(Cl)cc1 |c:56|
BDBM145062 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(NC4CCOCC4)c(c3)[N+]([O-])=O)c(Oc3cc4cc[nH]c4cc3F)c2)=C(C1)c1ccc(Cl)cc1 |c:57|
BDBM145063 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(NN4CCOCC4)c(c3)[N+]([O-])=O)c(Oc3cc4cc[nH]c4cc3F)c2)=C(C1)c1ccc(Cl)cc1 |c:57|
BDBM145108 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(NCC4CCOCC4)c(c3)[N+]([O-])=O)c(Oc3ccc4[nH]cc(CCN)c4c3)c2)=C(C1)c1ccc(Cl)cc1 |c:60|
BDBM145109 CN1CCN(CC1)Nc1ccc(cc1[N+]([O-])=O)S(=O)(=O)NC(=O)c1ccc(cc1Oc1ccc2[nH]cc(CCN)c2c1)N1CCN(CC2=C(CC(C)(C)CC2)c2ccc(Cl)cc2)CC1 |t:52|
BDBM145110 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3cnc(OCC4CCOCC4)c(c3)C#N)c(Oc3cc4cc[nH]c4cc3F)c2)=C(C1)c1ccc(Cl)cc1 |c:57|
BDBM144822 CN1CCC(CC1)Nc1ccc(cc1[N+]([O-])=O)S(=O)(=O)NC(=O)c1ccc(cc1Oc1ccc2[nH]c(C)cc2c1)N1CCN(CC2=C(CC(C)(C)CC2)c2ccc(Cl)cc2)CC1 |t:50|
BDBM144823 Cc1cc2cc(Oc3cc(ccc3C(=O)NS(=O)(=O)c3ccc(NCCCN4CCOCC4)c(c3)[N+]([O-])=O)N3CCN(CC4=C(CC(C)(C)CC4)c4ccc(Cl)cc4)CC3)ccc2[nH]1 |t:46|
BDBM144824 [O-][N+](=O)c1cc(ccc1NCC1CCOCC1)S(=O)(=O)NC(=O)c1ccc(cc1Oc1ccccc1Cl)N1CCN(Cc2ccccc2-c2ccc(Cl)cc2)CC1
BDBM144883 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(NC4CCN(CC4)C4CC4)c(c3)[N+]([O-])=O)c(Oc3ccccc3Cl)c2)=C(C1)c1ccc(Cl)cc1 |c:57|
BDBM144884 CN1CCC(CC1)Nc1ccc(cc1[N+]([O-])=O)S(=O)(=O)NC(=O)c1ccc(cc1Oc1cccc2[nH]cc(C)c12)N1CCN(CC2=C(CC(C)(C)CC2)c2ccc(Cl)cc2)CC1 |t:50|
BDBM144885 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(NCCCN4CCOCC4)c(c3)[N+]([O-])=O)c(Oc3cc(Cl)ccc3Cl)c2)=C(C1)c1ccc(Cl)cc1 |c:57|
BDBM144886 Cn1ccc2c(Oc3cc(ccc3C(=O)NS(=O)(=O)c3ccc(NCCCN4CCOCC4)c(c3)[N+]([O-])=O)N3CCN(Cc4ccccc4-c4ccc(Cl)cc4)CC3)cccc12
BDBM144942 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(NC4CCN(CC4)C4CCOCC4)c(c3)[N+]([O-])=O)c(Oc3ccccc3F)c2)=C(C1)c1ccc(Cl)cc1 |c:60|
BDBM144943 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(NCCCN4CCOCC4)c(c3)[N+]([O-])=O)c(Oc3ccccc3F)c2)=C(C1)c1ccc(Cl)cc1 |c:56|
BDBM144944 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(NCCN4CCOCC4)c(c3)[N+]([O-])=O)c(Oc3ccccc3F)c2)=C(C1)c1ccc(Cl)cc1 |c:55|
BDBM144945 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(NC4CCN(CC4)C4CCOCC4)c(c3)[N+]([O-])=O)c(Oc3cccc(Cl)c3)c2)=C(C1)c1ccc(Cl)cc1 |c:60|
BDBM145004 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(NC4CCN(CCN5CCOCC5)CC4)c(c3)[N+]([O-])=O)c(Oc3cccc(Cl)c3)c2)=C(C1)c1ccc(Cl)cc1 |c:62|
BDBM145005 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(NCC4(N)CCOCC4)c(c3)[N+]([O-])=O)c(Oc3ccccc3Cl)c2)=C(C1)c1ccc(Cl)cc1 |c:55|
BDBM145006 CN1CCC(O)(CNc2ccc(cc2[N+]([O-])=O)S(=O)(=O)NC(=O)c2ccc(cc2Oc2ccccc2Cl)N2CCN(CC3=C(CC(C)(C)CC3)c3ccc(Cl)cc3)CC2)CC1 |t:45|
BDBM145064 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(NN4CCOCC4)c(c3)[N+]([O-])=O)c(Oc3cccc(Cl)c3)c2)=C(C1)c1ccc(Cl)cc1 |c:53|
BDBM145065 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(NCCCN4CCNC(=O)C4)c(c3)[N+]([O-])=O)c(Oc3ccccc3Cl)c2)=C(C1)c1ccc(Cl)cc1 |c:57|
BDBM145066 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(NC4CCN(CC4)C4CCOCC4)c(c3)[N+]([O-])=O)c(c2)-c2ccc(N)nc2)=C(C1)c1ccc(Cl)cc1 |c:59|
BDBM145111 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(NCC4CCOCC4)c(c3)[N+]([O-])=O)c(Oc3cnc(N)c(F)c3)c2)=C(C1)c1ccc(Cl)cc1 |c:55|
BDBM144825 [O-][N+](=O)c1cc(ccc1NCC1CCOCC1)S(=O)(=O)NC(=O)c1ccc(cc1Oc1cccc(Cl)c1)N1CCN(Cc2ccccc2-c2ccc(Cl)cc2)CC1
BDBM144826 [O-][N+](=O)c1cc(ccc1NCC1CCOCC1)S(=O)(=O)NC(=O)c1ccc(cc1Oc1ccc(Cl)cc1)N1CCN(Cc2ccccc2-c2ccc(Cl)cc2)CC1
BDBM144827 [O-][N+](=O)c1cccc(Oc2cc(ccc2C(=O)NS(=O)(=O)c2ccc(NCC3CCOCC3)c(c2)[N+]([O-])=O)N2CCN(Cc3ccccc3-c3ccc(Cl)cc3)CC2)c1
BDBM144828 OCc1cccc(Oc2cc(ccc2C(=O)NS(=O)(=O)c2ccc(NCCCN3CCOCC3)c(c2)[N+]([O-])=O)N2CCN(Cc3ccccc3-c3ccc(Cl)cc3)CC2)c1
BDBM144887 [O-][N+](=O)c1cc(ccc1NCCCN1CCOCC1)S(=O)(=O)NC(=O)c1ccc(cc1Oc1cccc(c1)N1CCOCC1)N1CCN(Cc2ccccc2-c2ccc(Cl)cc2)CC1
BDBM144888 CN(C)CCCNc1ccc(cc1[N+]([O-])=O)S(=O)(=O)NC(=O)c1ccc(cc1Oc1ccc2[nH]cc(CCC(=O)N3CCOCC3)c2c1)N1CCN(Cc2ccccc2-c2ccc(Cl)cc2)CC1
BDBM144889 [O-][N+](=O)c1cc(ccc1NCC1CCOCC1)S(=O)(=O)NC(=O)c1ccc(cc1Oc1cccc(OCc2ccccc2)c1)N1CCN(Cc2ccccc2-c2ccc(Cl)cc2)CC1
BDBM144946 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(NCCCN4CCOCC4)c(c3)[N+]([O-])=O)c(Oc3cccc(Cl)c3)c2)=C(C1)c1ccc(Cl)cc1 |c:56|
BDBM144947 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(NCCN4CCOCC4)c(c3)[N+]([O-])=O)c(Oc3cccc(F)c3)c2)=C(C1)c1ccc(Cl)cc1 |c:55|
BDBM144948 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(NC4CCN(CC4)C4CCCC4)c(c3)[N+]([O-])=O)c(Oc3cccc(Cl)c3)c2)=C(C1)c1ccc(Cl)cc1 |c:59|
BDBM144949 CN1CCC(CC1)Nc1ccc(cc1S(=O)(=O)C(F)(F)F)S(=O)(=O)NC(=O)c1ccc(cc1Oc1cccc(Cl)c1)N1CCN(CC2=C(CC(C)(C)CC2)c2ccc(Cl)cc2)CC1 |t:50|
BDBM145007 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(NC4CCN(CC4)C4CCOCC4)c(c3)[N+]([O-])=O)c(Oc3cc4cc[nH]c4cc3F)c2)=C(C1)c1ccc(Cl)cc1 |c:64|
BDBM145008 CN1CC[C@@H](C1)Nc1ccc(cc1[N+]([O-])=O)S(=O)(=O)NC(=O)c1ccc(cc1Oc1cccc(Cl)c1)N1CCN(CC2=C(CC(C)(C)CC2)c2ccc(Cl)cc2)CC1 |t:45|
BDBM145009 CN1CC[C@H](C1)Nc1ccc(cc1[N+]([O-])=O)S(=O)(=O)NC(=O)c1ccc(cc1Oc1cccc(Cl)c1)N1CCN(CC2=C(CC(C)(C)CC2)c2ccc(Cl)cc2)CC1 |t:45|
BDBM145025 CN(C)CCCNc1ccc(cc1[N+]([O-])=O)S(=O)(=O)NC(=O)c1ccc(cc1Oc1cccc2n(CN3CCN(C)CC3)cc(CN3CCN(C)CC3)c12)N1CCN(CC2=C(CC(C)(C)CC2)c2ccc(Cl)cc2)CC1 |t:65|
BDBM145067 CC(N1CCN(CC1)c1ccc(C(=O)NS(=O)(=O)c2ccc(NCC3CCOCC3)c(c2)[N+]([O-])=O)c(Oc2cc3cc[nH]c3cc2F)c1)C1=C(CC(C)(C)CC1)c1ccc(Cl)cc1 |t:54|
BDBM145068 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(NCCCN4CCNC(=O)C4)c(c3)[N+]([O-])=O)c(Oc3cc(F)cc4[nH]ccc34)c2)=C(C1)c1ccc(Cl)cc1 |c:61|
BDBM145069 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(NC[C@@H]4CCCOC4)c(c3)[N+]([O-])=O)c(Oc3cc4cc[nH]c4cc3F)c2)=C(C1)c1ccc(Cl)cc1 |c:58|
BDBM145114 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3cnc(OCC4COCCO4)c(c3)C#N)c(Oc3cc4cc[nH]c4cc3F)c2)=C(C1)c1ccc(Cl)cc1 |c:57|
BDBM145115 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3cnc(OCC4COCCO4)c(Br)c3)c(Oc3cc4cc[nH]c4cc3F)c2)=C(C1)c1ccc(Cl)cc1 |c:56|
BDBM145116 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3cnc(NC4CCC(CC4)N4CCOCC4)c(Br)c3)c(Oc3cc4cc[nH]c4cc3F)c2)=C(C1)c1ccc(Cl)cc1 |c:62,(.55,-12.15,;1.37,-10.84,;-.17,-10.89,;1.37,-9.3,;2.7,-8.53,;4.03,-9.3,;5.37,-8.53,;5.37,-6.99,;6.7,-6.22,;6.7,-4.68,;5.37,-3.91,;4.03,-4.68,;4.03,-6.22,;5.37,-2.37,;6.7,-1.6,;6.7,-.06,;5.37,.71,;5.37,2.25,;6.7,3.02,;4.03,3.02,;4.03,4.56,;2.49,4.56,;5.57,4.56,;4.03,6.1,;5.37,6.87,;5.37,8.41,;4.03,9.18,;4.03,10.72,;5.37,11.49,;5.37,13.03,;6.7,13.8,;8.03,13.03,;8.03,11.49,;6.7,10.72,;9.37,13.8,;9.37,15.34,;10.7,16.11,;12.03,15.34,;12.03,13.8,;10.7,13.03,;2.7,8.41,;1.37,9.18,;2.7,6.87,;4.03,-.06,;2.7,.71,;1.37,-.06,;.03,.71,;-1.3,-.06,;-2.77,.42,;-3.67,-.83,;-2.77,-2.08,;-1.3,-1.6,;.03,-2.37,;1.37,-1.6,;2.7,-2.37,;4.03,-1.6,;4.03,-10.84,;2.7,-11.61,;5.37,-11.61,;6.7,-10.84,;8.03,-11.61,;8.03,-13.15,;9.37,-13.92,;6.7,-13.92,;5.37,-13.15,)|
BDBM144829 CN(C)CCCNc1ccc(cc1[N+]([O-])=O)S(=O)(=O)NC(=O)c1ccc(cc1Oc1ccccc1Cl)N1CCN(Cc2ccccc2-c2ccc(Cl)cc2)CC1
BDBM144830 [O-][N+](=O)c1cc(ccc1NCCCN1CCOCC1)S(=O)(=O)NC(=O)c1ccc(cc1Oc1cccc(Cl)c1)N1CCN(Cc2ccccc2-c2ccc(Cl)cc2)CC1
BDBM144831 [O-][N+](=O)c1cc(ccc1NCCCN1CCOCC1)S(=O)(=O)NC(=O)c1ccc(cc1Oc1ccc(Cl)cc1)N1CCN(Cc2ccccc2-c2ccc(Cl)cc2)CC1
BDBM144832 CN(C)CCCNc1ccc(cc1[N+]([O-])=O)S(=O)(=O)NC(=O)c1ccc(cc1Oc1cccc(Cl)c1)N1CCN(Cc2ccccc2-c2ccc(Cl)cc2)CC1
BDBM144890 [O-][N+](=O)c1cc(ccc1NCC1CCOCC1)S(=O)(=O)NC(=O)c1ccc(cc1Oc1ccc(cc1)C#N)N1CCN(Cc2ccccc2-c2ccc(Cl)cc2)CC1
BDBM144891 [O-][N+](=O)c1cc(ccc1NCC1CCOCC1)S(=O)(=O)NC(=O)c1ccc(cc1Oc1ccc2[nH]cc(CCC(=O)N3CCOCC3)c2c1)N1CCN(Cc2ccccc2-c2ccc(Cl)cc2)CC1
BDBM144892 [O-][N+](=O)c1cc(ccc1NCC1CCOCC1)S(=O)(=O)NC(=O)c1ccc(cc1Oc1ccc2[nH]cc(CCCN3CCOCC3)c2c1)N1CCN(Cc2ccccc2-c2ccc(Cl)cc2)CC1
BDBM144950 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(NC4CCN(CC4)C4CC4)c(c3)[N+]([O-])=O)c(Oc3cccc(F)c3)c2)=C(C1)c1ccc(Cl)cc1 |c:57|
BDBM144951 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(NC4CCN(CC4)C4CCCC4)c(c3)[N+]([O-])=O)c(Oc3cccc(F)c3F)c2)=C(C1)c1ccc(Cl)cc1 |c:60|
BDBM144952 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(NC4CCN(CC4)C4CCCC4)c(c3)[N+]([O-])=O)c(Oc3ccccc3F)c2)=C(C1)c1ccc(Cl)cc1 |c:59|
BDBM144953 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(NCCN4CCOCC4)c(c3)[N+]([O-])=O)c(Oc3cccc(F)c3F)c2)=C(C1)c1ccc(Cl)cc1 |c:56|
BDBM145010 CN1CCC(CC1)Nc1ccc(cc1[N+]([O-])=O)S(=O)(=O)NC(=O)c1ccc(cc1Oc1cccc(c1)-c1ccc[nH]1)N1CCN(CC2=C(CC(C)(C)CC2)c2ccc(Cl)cc2)CC1 |t:51|
BDBM145011 CN1CCC(O)(CNc2ccc(cc2[N+]([O-])=O)S(=O)(=O)NC(=O)c2ccc(cc2Oc2cccc(F)c2)N2CCN(CC3=C(CC(C)(C)CC3)c3ccc(Cl)cc3)CC2)CC1 |t:45|
BDBM145012 CN1CCN(CC1)Nc1ccc(cc1[N+]([O-])=O)S(=O)(=O)NC(=O)c1ccc(cc1Oc1cccc(Cl)c1)N1CCN(CC2=C(CC(C)(C)CC2)c2ccc(Cl)cc2)CC1 |t:46|
BDBM145026 CN(C)CCCNc1ccc(cc1[N+]([O-])=O)S(=O)(=O)NC(=O)c1ccc(cc1Oc1cccc2[nH]cc(CN3CCN(C)CC3)c12)N1CCN(CC2=C(CC(C)(C)CC2)c2ccc(Cl)cc2)CC1 |t:56|
BDBM145027 CN(C)C(=O)c1ccccc1Oc1cc(ccc1C(=O)NS(=O)(=O)c1ccc(NC2CCN(C)CC2)c(c1)[N+]([O-])=O)N1CCN(CC2=C(CC(C)(C)CC2)c2ccc(Cl)cc2)CC1 |t:50|
BDBM145070 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(NC[C@H]4CCCOC4)c(c3)[N+]([O-])=O)c(Oc3cc4cc[nH]c4cc3F)c2)=C(C1)c1ccc(Cl)cc1 |c:58|
BDBM145071 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(NC4CCN(CC4)C4CCOCC4)c(c3)[N+]([O-])=O)c(Oc3ccc(N)nc3)c2)=C(C1)c1ccc(Cl)cc1 |c:60|
BDBM145072 CC1(C)CCC(=C(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(NCC4CCOCC4)c(c3)[N+]([O-])=O)c(Oc3cc4cc[nH]c4cc3F)c2)C1)c1ccc(Cl)cc1 |t:5|
BDBM145117 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3cnc(OCC4(F)CCOCC4)c(c3)C#N)c(Oc3cc4cc[nH]c4cc3F)c2)=C(C1)c1ccc(Cl)cc1 |c:58|
BDBM145118 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(NCC4CCOCC4)c(c3)[N+]([O-])=O)c(Oc3cc(N)cc(Cl)c3)c2)=C(C1)c1ccc(Cl)cc1 |c:55|
BDBM145119 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3cnc(OCCN4CCOCC4)c(c3)C#N)c(Oc3cc4cc[nH]c4cc3F)c2)=C(C1)c1ccc(Cl)cc1 |c:58|
BDBM144833 CN(C)CCCNc1ccc(cc1[N+]([O-])=O)S(=O)(=O)NC(=O)c1ccc(cc1Oc1ccc(Cl)cc1)N1CCN(Cc2ccccc2-c2ccc(Cl)cc2)CC1
BDBM144834 CN(C)CCCNc1ccc(cc1[N+]([O-])=O)S(=O)(=O)NC(=O)c1ccc(cc1Oc1cccc2n(C)ccc12)N1CCN(Cc2ccccc2-c2ccc(Cl)cc2)CC1
BDBM144835 CC(=O)Nc1cccc(Oc2cc(ccc2C(=O)NS(=O)(=O)c2ccc(NCC3CCOCC3)c(c2)[N+]([O-])=O)N2CCN(Cc3ccccc3-c3ccc(Cl)cc3)CC2)c1
BDBM144836 Nc1ccc(Oc2cc(ccc2C(=O)NS(=O)(=O)c2ccc(NCC3CCOCC3)c(c2)[N+]([O-])=O)N2CCN(Cc3ccccc3-c3ccc(Cl)cc3)CC2)cc1
BDBM144893 CN(C)Cc1ccc(Oc2cc(ccc2C(=O)NS(=O)(=O)c2ccc(NCC3CCOCC3)c(c2)[N+]([O-])=O)N2CCN(Cc3ccccc3-c3ccc(Cl)cc3)CC2)cc1
BDBM144894 [O-][N+](=O)c1cc(ccc1NCC1CCOCC1)S(=O)(=O)NC(=O)c1ccc(cc1Oc1ccc(cc1)-n1ccnc1)N1CCN(Cc2ccccc2-c2ccc(Cl)cc2)CC1
BDBM144895 [O-][N+](=O)c1cccc(Oc2cc(ccc2C(=O)NS(=O)(=O)c2ccc(NCC3CCOCC3)cc2)N2CCN(Cc3ccccc3-c3ccc(Cl)cc3)CC2)c1
BDBM144896 CCN(Cc1ccc(Oc2cc(ccc2C(=O)NS(=O)(=O)c2ccc(NCC3CCOCC3)c(c2)[N+]([O-])=O)N2CCN(Cc3ccccc3-c3ccc(Cl)cc3)CC2)cc1)C(=O)OC(C)(C)C
BDBM144954 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(NC4CCN(Cc5ccsc5)CC4)c(c3)[N+]([O-])=O)c(Oc3cccc(F)c3F)c2)=C(C1)c1ccc(Cl)cc1 |c:61|
BDBM144955 CN(C)CCCNc1ccc(cc1[N+]([O-])=O)S(=O)(=O)NC(=O)c1ccc(cc1Oc1ccccc1F)N1CCN(CC2=C(CC(C)(C)CC2)c2ccc(Cl)cc2)CC1 |t:44|
BDBM144956 CN(C)CCCNc1ccc(cc1[N+]([O-])=O)S(=O)(=O)NC(=O)c1ccc(cc1Oc1cccc(F)c1)N1CCN(CC2=C(CC(C)(C)CC2)c2ccc(Cl)cc2)CC1 |t:44|
BDBM144957 CN(C)CCCNc1ccc(cc1[N+]([O-])=O)S(=O)(=O)NC(=O)c1ccc(cc1Oc1ccc(F)cc1)N1CCN(CC2=C(CC(C)(C)CC2)c2ccc(Cl)cc2)CC1 |t:44|
BDBM145013 CN1CCC(CC1)Nc1ccc(cc1[N+]([O-])=O)S(=O)(=O)NC(=O)c1ccc(cc1Oc1cc2cc[nH]c2c(F)c1F)N1CCN(CC2=C(CC(C)(C)CC2)c2ccc(Cl)cc2)CC1 |t:51|
BDBM145014 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(NC4CCN(CC4)C4CCOCC4)c(c3)[N+]([O-])=O)c(Oc3cc4cc[nH]c4c(F)c3F)c2)=C(C1)c1ccc(Cl)cc1 |c:65|
BDBM145015 CN1CCC(CC1)Nc1ccc(cc1[N+]([O-])=O)S(=O)(=O)NC(=O)c1ccc(cc1Oc1cccc2n(ccc12)C(=O)OC(C)(C)C)N1CCN(CC2=C(CC(C)(C)CC2)c2ccc(Cl)cc2)CC1 |t:56|
BDBM145073 COCCNc1ccc(cc1[N+]([O-])=O)S(=O)(=O)NC(=O)c1ccc(cc1Oc1cc2cc[nH]c2cc1F)N1CCN(CC2=C(CC(C)(C)CC2)c2ccc(Cl)cc2)CC1 |t:46|
BDBM145074 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(OCC4CCOCC4)c(c3)[N+]([O-])=O)c(Oc3cc4cc[nH]c4cc3F)c2)=C(C1)c1ccc(Cl)cc1 |c:58|
BDBM145075 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(NCC4CCOCC4)c(c3)[N+]([O-])=O)c(Oc3ccc4[nH]cc(Cl)c4c3)c2)=C(C1)c1ccc(Cl)cc1 |c:58|
BDBM145120 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(OC4CCC(CC4)N4CCOCC4)c(c3)[N+]([O-])=O)c(Oc3cc4cc[nH]c4cc3F)c2)=C(C1)c1ccc(Cl)cc1 |c:64,(-1.64,-14.42,;-.82,-13.11,;-2.36,-13.17,;-.82,-11.57,;.51,-10.8,;1.84,-11.57,;3.18,-10.8,;3.18,-9.26,;4.51,-8.49,;4.51,-6.95,;3.18,-6.18,;1.84,-6.95,;1.84,-8.49,;3.18,-4.64,;4.51,-3.87,;4.51,-2.33,;3.18,-1.56,;3.18,-.02,;1.84,.75,;4.51,.75,;4.51,2.29,;6.05,2.29,;2.97,2.29,;4.51,3.83,;5.84,4.6,;5.84,6.14,;4.51,6.91,;4.51,8.45,;5.84,9.22,;5.84,10.76,;7.18,11.53,;8.51,10.76,;8.51,9.22,;7.18,8.45,;9.84,11.53,;9.84,13.07,;11.18,13.84,;12.51,13.07,;12.51,11.53,;11.18,10.76,;3.18,6.14,;3.18,4.6,;1.84,6.91,;.51,6.14,;1.84,8.45,;1.84,-2.33,;.51,-1.56,;-.82,-2.33,;-2.16,-1.56,;-3.49,-2.33,;-4.96,-1.86,;-5.86,-3.1,;-4.96,-4.35,;-3.49,-3.87,;-2.16,-4.64,;-.82,-3.87,;.51,-4.64,;1.84,-3.87,;1.84,-13.11,;.51,-13.88,;3.18,-13.88,;4.51,-13.11,;5.84,-13.88,;5.84,-15.42,;7.18,-16.19,;4.51,-16.19,;3.18,-15.42,)|
BDBM145121 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3cnc(NC4CCN(CC4)C4CCOCC4)c(Br)c3)c(Oc3cc4cc[nH]c4cc3F)c2)=C(C1)c1ccc(Cl)cc1 |c:62|
BDBM145122 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(OCC4(F)CCOCC4)c(c3)[N+]([O-])=O)c(Oc3cccc4NC(=O)Cc34)c2)=C(C1)c1ccc(Cl)cc1 |c:59|
BDBM144837 Nc1cccc(Oc2cc(ccc2C(=O)NS(=O)(=O)c2ccc(NCC3CCOCC3)c(c2)[N+]([O-])=O)N2CCN(Cc3ccccc3-c3ccc(Cl)cc3)CC2)c1
BDBM144838 COc1cccc(Oc2cc(ccc2C(=O)NS(=O)(=O)c2ccc(NCC3CCOCC3)c(c2)[N+]([O-])=O)N2CCN(Cc3ccccc3-c3ccc(Cl)cc3)CC2)c1
BDBM144839 CN(C)c1cccc(Oc2cc(ccc2C(=O)NS(=O)(=O)c2ccc(NCC3CCOCC3)c(c2)[N+]([O-])=O)N2CCN(Cc3ccccc3-c3ccc(Cl)cc3)CC2)c1
BDBM144840 [O-][N+](=O)c1cc(ccc1NCC1CCOCC1)S(=O)(=O)NC(=O)c1ccc(cc1Oc1cccc(c1)C#N)N1CCN(Cc2ccccc2-c2ccc(Cl)cc2)CC1
BDBM144897 CCN(Cc1cccc(Oc2cc(ccc2C(=O)NS(=O)(=O)c2ccc(NCC3CCOCC3)c(c2)[N+]([O-])=O)N2CCN(Cc3ccccc3-c3ccc(Cl)cc3)CC2)c1)C(=O)OC(C)(C)C
BDBM144898 CCNCc1ccc(Oc2cc(ccc2C(=O)NS(=O)(=O)c2ccc(NCC3CCOCC3)c(c2)[N+]([O-])=O)N2CCN(Cc3ccccc3-c3ccc(Cl)cc3)CC2)cc1
BDBM144899 CCNCc1cccc(Oc2cc(ccc2C(=O)NS(=O)(=O)c2ccc(NCC3CCOCC3)c(c2)[N+]([O-])=O)N2CCN(Cc3ccccc3-c3ccc(Cl)cc3)CC2)c1
BDBM144900 CC(=O)Nc1ccc(Oc2cc(ccc2C(=O)NS(=O)(=O)c2ccc(NCC3CCOCC3)c(c2)[N+]([O-])=O)N2CCN(Cc3ccccc3-c3ccc(Cl)cc3)CC2)cc1
BDBM144958 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(NC4CCN(CCF)CC4)c(c3)[N+]([O-])=O)c(Oc3cccc(F)c3F)c2)=C(C1)c1ccc(Cl)cc1 |c:57|
BDBM144959 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(NCCN4CCOCC4)c(c3)[N+]([O-])=O)c(Oc3cccc(Cl)c3)c2)=C(C1)c1ccc(Cl)cc1 |c:55|
BDBM144960 CN(C)CCCNc1ccc(cc1[N+]([O-])=O)S(=O)(=O)NC(=O)c1ccc(cc1Oc1cccc(Cl)c1)N1CCN(CC2=C(CC(C)(C)CC2)c2ccc(Cl)cc2)CC1 |t:44|
BDBM144961 CN1CCN(CCCNc2ccc(cc2[N+]([O-])=O)S(=O)(=O)NC(=O)c2ccc(cc2Oc2cccc(Cl)c2)N2CCN(CC3=C(CC(C)(C)CC3)c3ccc(Cl)cc3)CC2)CC1 |t:46|
BDBM145016 CN(C)C1CCC(CC1)Nc1ccc(cc1[N+]([O-])=O)S(=O)(=O)NC(=O)c1ccc(cc1Oc1cccc(Cl)c1)N1CCN(CC2=C(CC(C)(C)CC2)c2ccc(Cl)cc2)CC1 |t:48,(9.34,10.01,;8,10.78,;8,12.32,;6.67,10.01,;5.33,10.78,;4,10.01,;4,8.47,;5.33,7.7,;6.67,8.47,;2.67,7.7,;2.67,6.16,;4,5.39,;4,3.85,;2.67,3.08,;1.33,3.85,;1.33,5.39,;,6.16,;,7.7,;-1.33,5.39,;2.67,1.54,;1.13,1.54,;4.21,1.54,;2.67,,;4,-.77,;5.33,,;4,-2.31,;2.67,-3.08,;2.67,-4.62,;4,-5.39,;5.33,-4.62,;5.33,-3.08,;6.67,-2.31,;8,-3.08,;8,-4.62,;9.34,-5.39,;10.67,-4.62,;10.67,-3.08,;12,-2.31,;9.34,-2.31,;4,-6.93,;5.33,-7.7,;5.33,-9.24,;4,-10.01,;4,-11.55,;2.67,-12.32,;2.67,-13.86,;1.33,-14.63,;,-13.86,;-.82,-15.17,;-1.54,-13.91,;,-12.32,;1.33,-11.55,;4,-14.63,;5.33,-13.86,;6.67,-14.63,;6.67,-16.17,;8,-16.94,;5.33,-16.94,;4,-16.17,;2.67,-9.24,;2.67,-7.7,)|
BDBM145017 CCN(CC)C1CCC(CC1)Nc1ccc(cc1[N+]([O-])=O)S(=O)(=O)NC(=O)c1ccc(cc1Oc1cccc(Cl)c1)N1CCN(CC2=C(CC(C)(C)CC2)c2ccc(Cl)cc2)CC1 |t:50,(10.67,10.78,;9.34,10.01,;8,10.78,;8,12.32,;6.67,13.09,;6.67,10.01,;5.33,10.78,;4,10.01,;4,8.47,;5.33,7.7,;6.67,8.47,;2.67,7.7,;2.67,6.16,;4,5.39,;4,3.85,;2.67,3.08,;1.33,3.85,;1.33,5.39,;,6.16,;,7.7,;-1.33,5.39,;2.67,1.54,;1.13,1.54,;4.21,1.54,;2.67,,;4,-.77,;5.33,,;4,-2.31,;2.67,-3.08,;2.67,-4.62,;4,-5.39,;5.33,-4.62,;5.33,-3.08,;6.67,-2.31,;8,-3.08,;8,-4.62,;9.34,-5.39,;10.67,-4.62,;10.67,-3.08,;12,-2.31,;9.34,-2.31,;4,-6.93,;5.33,-7.7,;5.33,-9.24,;4,-10.01,;4,-11.55,;2.67,-12.32,;2.67,-13.86,;1.33,-14.63,;,-13.86,;-.82,-15.17,;-1.54,-13.91,;,-12.32,;1.33,-11.55,;4,-14.63,;5.33,-13.86,;6.67,-14.63,;6.67,-16.17,;8,-16.94,;5.33,-16.94,;4,-16.17,;2.67,-9.24,;2.67,-7.7,)|
BDBM145028 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(NC4CCN(CC4)C4CCOCC4)c(c3)[N+]([O-])=O)c(Oc3cccc4[nH]c(cc34)C(F)(F)F)c2)=C(C1)c1ccc(Cl)cc1 |c:67|
BDBM145029 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(NC4CCN(CC4)C4CCOCC4)c(c3)[N+]([O-])=O)c(Oc3ccc(O)cc3Cl)c2)=C(C1)c1ccc(Cl)cc1 |c:61|
BDBM145076 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(NCC4CCOCC4)c(c3)[N+]([O-])=O)c(Oc3cccc4[nH]cc(Cl)c34)c2)=C(C1)c1ccc(Cl)cc1 |c:58|
BDBM145077 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(NCC4CCOCC4)c(c3)[N+]([O-])=O)c(Oc3ccc4NC(=O)Cc4c3)c2)=C(C1)c1ccc(Cl)cc1 |c:58|
BDBM145078 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(NCC4CCOCC4)c(c3)[N+]([O-])=O)c(Oc3cccc4NC(=O)Cc34)c2)=C(C1)c1ccc(Cl)cc1 |c:58|
BDBM144841 Cc1nc2ccc(Oc3cc(ccc3C(=O)NS(=O)(=O)c3ccc(NCC4CCOCC4)c(c3)[N+]([O-])=O)N3CCN(Cc4ccccc4-c4ccc(Cl)cc4)CC3)cc2s1
BDBM144843 CN(C)CCCNc1ccc(cc1[N+]([O-])=O)S(=O)(=O)NC(=O)c1ccc(cc1Oc1ccc2sc(C)nc2c1)N1CCN(Cc2ccccc2-c2ccc(Cl)cc2)CC1
BDBM144842 Cc1nc2cc(Oc3cc(ccc3C(=O)NS(=O)(=O)c3ccc(NCCCN4CCOCC4)c(c3)[N+]([O-])=O)N3CCN(Cc4ccccc4-c4ccc(Cl)cc4)CC3)ccc2s1
BDBM144844 CN(C)C(=O)CCc1ccccc1Oc1cc(ccc1C(=O)NS(=O)(=O)c1ccc(NCC2CCOCC2)c(c1)[N+]([O-])=O)N1CCN(Cc2ccccc2-c2ccc(Cl)cc2)CC1
BDBM144903 CC(C)(C)OC(=O)Nc1cccc(Oc2cc(ccc2C(=O)NS(=O)(=O)c2ccc(NCC3CCOCC3)c(c2)[N+]([O-])=O)N2CCN(Cc3ccccc3-c3ccc(Cl)cc3)CC2)c1
BDBM144901 CC(C)(C)OC(=O)Nc1ccc(Oc2cc(ccc2C(=O)NS(=O)(=O)c2ccc(NCC3CCOCC3)c(c2)[N+]([O-])=O)N2CCN(Cc3ccccc3-c3ccc(Cl)cc3)CC2)cc1
BDBM144902 [O-][N+](=O)c1cc(ccc1NCC1CCOCC1)S(=O)(=O)NC(=O)c1ccc(cc1Oc1ccccc1-c1ccccc1)N1CCN(Cc2ccccc2-c2ccc(Cl)cc2)CC1
BDBM144904 [O-][N+](=O)c1cc(ccc1NCC1CCOCC1)S(=O)(=O)NC(=O)c1ccc(cc1Oc1cccc(c1)-c1ccccc1)N1CCN(Cc2ccccc2-c2ccc(Cl)cc2)CC1
BDBM144962 CN1CCC(CC1)Nc1ccc(cc1[N+]([O-])=O)S(=O)(=O)NC(=O)c1ccc(cc1Oc1cccc(Cl)c1)N1CCN(CC2=C(CC(C)(C)OC2)c2ccc(Cl)cc2)CC1 |t:46|
BDBM144963 CN1CCC(CC1)Nc1ccc(cc1[N+]([O-])=O)S(=O)(=O)NC(=O)c1ccc(cc1Oc1cccc(F)c1F)N1CCN(CC2=C(CC(C)(C)OC2)c2ccc(Cl)cc2)CC1 |t:47|
BDBM144964 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(NC4CCN(CC=C)CC4)c(c3)[N+]([O-])=O)c(Oc3cccc(F)c3F)c2)=C(C1)c1ccc(Cl)cc1 |c:57|
BDBM144965 CN1CCC(CC1)Nc1ccc(cc1[N+]([O-])=O)S(=O)(=O)NC(=O)c1ccc(cc1Oc1cccc(Cl)c1F)N1CCN(CC2=C(CC(C)(C)CC2)c2ccc(Cl)cc2)CC1 |t:47|
BDBM145018 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(NC4CCC(CC4)N4CCOCC4)c(c3)[N+]([O-])=O)c(Oc3cccc(Cl)c3)c2)=C(C1)c1ccc(Cl)cc1 |c:60,(-2.67,-14.27,;-1.86,-12.96,;-3.39,-13.02,;-1.86,-11.42,;-.52,-10.65,;.81,-11.42,;2.15,-10.65,;2.15,-9.11,;3.48,-8.34,;3.48,-6.8,;2.15,-6.03,;.81,-6.8,;.81,-8.34,;2.15,-4.49,;.81,-3.72,;.81,-2.18,;2.15,-1.41,;2.15,.13,;3.48,.9,;.81,.9,;.81,2.44,;-.73,2.44,;2.35,2.44,;.81,3.98,;2.15,4.75,;2.15,6.29,;.81,7.06,;.81,8.6,;2.15,9.37,;2.15,10.91,;3.48,11.68,;4.81,10.91,;4.81,9.37,;3.48,8.6,;6.15,11.68,;6.15,13.22,;7.48,13.99,;8.81,13.22,;8.81,11.68,;7.48,10.91,;-.52,6.29,;-.52,4.75,;-1.86,7.06,;-3.19,6.29,;-1.86,8.6,;3.48,-2.18,;4.81,-1.41,;6.15,-2.18,;6.15,-3.72,;7.48,-4.49,;8.81,-3.72,;8.81,-2.18,;10.15,-1.41,;7.48,-1.41,;3.48,-3.72,;.81,-12.96,;-.52,-13.73,;2.15,-13.73,;3.48,-12.96,;4.81,-13.73,;4.81,-15.27,;6.15,-16.04,;3.48,-16.04,;2.15,-15.27,)|
BDBM145019 CC(N1CCN(CC1)c1ccc(C(=O)NS(=O)(=O)c2ccc(NC3CCN(C)CC3)c(c2)[N+]([O-])=O)c(Oc2ccccc2Cl)c1)c1ccccc1-c1ccc(Cl)cc1
BDBM145020 CN1CCC(CC1)Nc1ccc(cc1[N+]([O-])=O)S(=O)(=O)NC(=O)c1ccc(cc1Oc1ccc(O)cc1Cl)N1CCN(CC2=C(CC(C)(C)CC2)c2ccc(Cl)cc2)CC1 |t:47|
BDBM145031 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(NC4CCN(CC4)C4CCOCC4)c(c3)[N+]([O-])=O)c(OCc3csc(N)n3)c2)=C(C1)c1ccc(Cl)cc1 |c:60|
BDBM145032 CN1CCN(CC1)Nc1ccc(cc1[N+]([O-])=O)S(=O)(=O)NC(=O)c1ccc(cc1Oc1cc2cc[nH]c2c(F)c1F)N1CCN(CC2=C(CC(C)(C)CC2)c2ccc(Cl)cc2)CC1 |t:51|
BDBM145033 CN1CCN(CC1)Nc1ccc(cc1[N+]([O-])=O)S(=O)(=O)NC(=O)c1ccc(cc1Oc1cc2cc[nH]c2cc1F)N1CCN(CC2=C(CC(C)(C)CC2)c2ccc(Cl)cc2)CC1 |t:50|
BDBM145079 COCCNc1ccc(cc1[N+]([O-])=O)S(=O)(=O)NC(=O)c1ccc(cc1Oc1cc(F)cc2[nH]ccc12)N1CCN(CC2=C(CC(C)(C)CC2)c2ccc(Cl)cc2)CC1 |t:46|
BDBM145080 CC(C)(C)OC(=O)Nc1ccc(Oc2cc(ccc2C(=O)NS(=O)(=O)c2ccc(NCC3CCOCC3)c(c2)[N+]([O-])=O)N2CCN(CC3=C(CC(C)(C)CC3)c3ccc(Cl)cc3)CC2)cn1 |t:50|
BDBM145081 CC(C)(C)OC(=O)Nc1cc(Oc2cc(ccc2C(=O)NS(=O)(=O)c2ccc(NC3CCN(CC3)C3CCOCC3)c(c2)[N+]([O-])=O)N2CCN(CC3=C(CC(C)(C)CC3)c3ccc(Cl)cc3)CC2)ccn1 |t:55|
BDBM145156 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(NCCCN4CCOCC4)c(c3)S(=O)(=O)C(F)(F)F)c(Oc3cnc(N)c(Cl)c3)c2)=C(C1)c1ccc(Cl)cc1 |c:61|
BDBM145157 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(OCC4(F)CCOCC4)c(c3)S(=O)(=O)C(F)(F)F)c(Oc3cnc(N)c(Cl)c3)c2)=C(C1)c1ccc(Cl)cc1 |c:60|
BDBM145158 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3cnc(OCC4(F)CCOCC4)c(Cl)c3)c(Oc3cnc(N)c(Cl)c3)c2)=C(C1)c1ccc(Cl)cc1 |c:54|
BDBM145159 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(NCC4CCOCC4)c(c3)[N+]([O-])=O)c(Oc3cnc(N)c(Br)c3)c2)=C(C1)c1ccc(Cl)cc1 |c:55|
BDBM145209 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3cnc(OC[C@@H]4CCN(CC(F)F)C4)c(Cl)c3)c(Oc3cnc(N)c(Cl)c3)c2)=C(C1)c1ccc(Cl)cc1 |c:56|
BDBM145210 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(NCC4CCC(CC4)C#N)c(c3)[N+]([O-])=O)c(Oc3cnc(N)c(Cl)c3)c2)=C(C1)c1ccc(Cl)cc1 |c:57,(8.53,-13.15,;7.72,-11.85,;9.26,-11.9,;7.72,-10.31,;6.38,-9.54,;5.05,-10.31,;3.72,-9.54,;3.72,-8,;5.05,-7.23,;5.05,-5.69,;3.72,-4.92,;2.38,-5.69,;2.38,-7.23,;3.72,-3.38,;5.05,-2.61,;5.05,-1.07,;3.72,-.3,;3.72,1.24,;5.05,2.01,;2.38,2.01,;2.38,3.55,;2.38,5.09,;3.92,3.55,;.84,3.55,;.07,2.22,;-1.47,2.22,;-2.24,3.55,;-3.78,3.55,;-4.55,2.22,;-6.09,2.22,;-6.86,.88,;-8.4,.88,;-9.17,2.22,;-8.4,3.55,;-6.86,3.55,;-10.71,2.22,;-12.25,2.22,;-1.47,4.89,;.07,4.89,;-2.24,6.22,;-1.47,7.55,;-3.78,6.22,;2.38,-1.07,;1.05,-.3,;-.29,-1.07,;-1.62,-.3,;-2.95,-1.07,;-2.95,-2.61,;-4.29,-3.38,;-1.62,-3.38,;-1.62,-4.92,;-.29,-2.61,;2.38,-2.61,;5.05,-11.85,;6.38,-12.62,;3.72,-12.62,;3.72,-14.16,;2.38,-14.93,;1.05,-14.16,;-.29,-14.93,;1.05,-12.62,;2.38,-11.85,)|
BDBM145211 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3cnc(OCC4(F)CCOCC4)c(F)c3)c(Oc3cnc(N)c(Cl)c3)c2)=C(C1)c1ccc(Cl)cc1 |c:54|
BDBM145160 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(NCC4CCOCC4)c(c3)[N+]([O-])=O)c(Oc3cnc(N)c(c3)C(N)=O)c2)=C(C1)c1ccc(Cl)cc1 |c:57|
BDBM145161 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(NCC4CCOCC4)c(c3)[N+]([O-])=O)c(Oc3cnc(N)c(c3)C#N)c2)=C(C1)c1ccc(Cl)cc1 |c:56|
BDBM145162 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(N[C@@H]4CCN(CC(F)F)C4)c(c3)[N+]([O-])=O)c(Oc3cnc(N)c(Cl)c3)c2)=C(C1)c1ccc(Cl)cc1 |c:57|
BDBM145163 CN1CCC(CC1)Nc1ccc(cc1S(=O)(=O)C(F)(F)F)S(=O)(=O)NC(=O)c1ccc(cc1Oc1cnc(N)c(Cl)c1)N1CCN(CC2=C(CC(C)(C)CC2)c2ccc(Cl)cc2)CC1 |t:51|
BDBM145212 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3cnc(OCC4(F)CCN(CC(F)F)CC4)c(Cl)c3)c(Oc3cnc(N)c(Cl)c3)c2)=C(C1)c1ccc(Cl)cc1 |c:58|
BDBM145213 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(OCC4(F)CCOCC4)c(Cl)c3)c(Oc3cnc(N)c(Cl)c3)c2)=C(C1)c1ccc(Cl)cc1 |c:54|
BDBM145214 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3cnc(OCC4(F)CCN(CC4)C(CF)CF)c(c3)C(F)(F)F)c(Oc3cnc(N)c(Cl)c3)c2)=C(C1)c1ccc(Cl)cc1 |c:62|
BDBM145164 CC(=O)Nc1ccc(Oc2cc(ccc2C(=O)NS(=O)(=O)c2ccc(NCC3CCOCC3)c(c2)[N+]([O-])=O)N2CCN(CC3=C(CC(C)(C)CC3)c3ccc(Cl)cc3)CC2)cn1 |t:46|
BDBM145165 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(NCC4CCOCC4)c(c3)[N+]([O-])=O)c(Oc3ccc(NS(C)(=O)=O)nc3)c2)=C(C1)c1ccc(Cl)cc1 |c:58|
BDBM145166 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(N[C@@H]4CCN(C4)C(CF)CF)c(c3)[N+]([O-])=O)c(Oc3cc4cc[nH]c4cc3F)c2)=C(C1)c1ccc(Cl)cc1 |c:61|
BDBM145215 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(NCC4CCOCC4)c(c3)[N+]([O-])=O)c(Oc3ccccc3-c3cn[nH]c3)c2)=C(C1)c1ccc(Cl)cc1 |c:59|
BDBM145216 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(NCC4CCOCC4)c(c3)[N+]([O-])=O)c(Oc3ccccc3-c3cccnc3N)c2)=C(C1)c1ccc(Cl)cc1 |c:61|
BDBM145217 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(NCC4CCOCC4)c(c3)[N+]([O-])=O)c(Oc3ccccc3-c3ccn[nH]3)c2)=C(C1)c1ccc(Cl)cc1 |c:59|
BDBM145167 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(NC4CCN(CC4)C4CC4)c(c3)[N+]([O-])=O)c(Oc3cnc(N)c(Cl)c3)c2)=C(C1)c1ccc(Cl)cc1 |c:58|
BDBM145168 CN1CCN(CC1)Nc1ccc(cc1[N+]([O-])=O)S(=O)(=O)NC(=O)c1ccc(cc1Oc1cnc(N)c(Br)c1)N1CCN(CC2=C(CC(C)(C)CC2)c2ccc(Cl)cc2)CC1 |t:47|
BDBM145169 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(OCC4(F)CCOCC4)c(c3)[N+]([O-])=O)c(Oc3cnc(N)c(Br)c3)c2)=C(C1)c1ccc(Cl)cc1 |c:56|
BDBM145170 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(NCC4COCCO4)c(c3)[N+]([O-])=O)c(Oc3cnc(N)c(Br)c3)c2)=C(C1)c1ccc(Cl)cc1 |c:55|
BDBM145218 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3cnc(OCC4CCC(F)(F)CC4)c(Cl)c3)c(Oc3cnc(N)c(Cl)c3)c2)=C(C1)c1ccc(Cl)cc1 |c:55|
BDBM145219 CC1(C)CC(=C(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3cnc(OCC4CCC(F)(F)CC4)c(Cl)c3)c(Oc3cc4cc[nH]c4cc3F)c2)CO1)c1ccc(Cl)cc1 |t:4|
BDBM145220 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(NCC4CCC(F)(F)CC4)c(c3)[N+]([O-])=O)c(Oc3cc4cc[nH]c4cc3F)c2)=C(C1)c1ccc(Cl)cc1 |c:60|
BDBM161586 Cc1c(cc(-c2cc(Cl)ccc2C(=O)N2Cc3ccccc3C[C@H]2CN2CCOCC2)n1C)C(=O)N(c1ccc(O)cc1)c1ccc(F)c(c1)C#N
BDBM161585 COC(=O)c1ccnc(c1)N(C(=O)c1cc(-c2cc(Cl)ccc2C(=O)N2Cc3ccccc3C[C@H]2CN2CCOCC2)n(C)c1C)c1ccc(O)cc1
BDBM161589 Cc1c(cc(-c2cc(Cl)ccc2C(=O)N2Cc3ccccc3C[C@H]2CN2CCOCC2)n1C)C(=O)N(c1ccc(O)cc1)c1ccnc(n1)C#N
BDBM161590 Cc1c(cc(C#N)n1C)N(C(=O)c1cc(-c2ccccc2C(=O)N2Cc3ccccc3C[C@H]2CN2CCOCC2)n(C)c1C)c1ccc(O)cc1
BDBM161594 CN1CCc2cc(cnc12)N(C(=O)c1cc(-c2ccccc2C(=O)N2Cc3ccccc3C[C@H]2CN2CCOCC2)n(C)c1C)c1ccc(O)cc1
BDBM145171 Cc1cc(Oc2cc(ccc2C(=O)NS(=O)(=O)c2ccc(NCC3CCOCC3)c(c2)[N+]([O-])=O)N2CCN(CC3=C(CC(C)(C)CC3)c3ccc(Cl)cc3)CC2)cnc1N |t:42|
BDBM145172 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(NCC4(F)CCOCC4)c(c3)[N+]([O-])=O)c(Oc3cnc(N)c(Cl)c3)c2)=C(C1)c1ccc(Cl)cc1 |c:56|
BDBM145173 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(NC4CCN(CC4)C4COC4)c(c3)[N+]([O-])=O)c(Oc3cnc(N)c(Cl)c3)c2)=C(C1)c1ccc(Cl)cc1 |c:59|
BDBM145174 CC(C)c1cc(Oc2cc(ccc2C(=O)NS(=O)(=O)c2ccc(NCC3CCOCC3)c(c2)[N+]([O-])=O)N2CCN(CC3=C(CC(C)(C)CC3)c3ccc(Cl)cc3)CC2)cnc1N |t:44|
BDBM145221 [O-][N+](=O)c1cc(ccc1NCCCN1CCOCC1)S(=O)(=O)NC(=O)c1ccc(cc1Oc1ccccc1Cl)N1CCN(Cc2ccccc2-c2ccc(Cl)cc2)CC1
BDBM145126 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(OCC#CCN4CCOCC4)c(c3)[N+]([O-])=O)c(Oc3cc4cc[nH]c4cc3F)c2)=C(C1)c1ccc(Cl)cc1 |c:61|
BDBM145127 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(NCC4CCOCC4)c(c3)[N+]([O-])=O)c(Oc3cnc(N)c(Cl)c3)c2)=C(C1)c1ccc(Cl)cc1 |c:55|
BDBM145128 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(NC4CCN(CC4)S(C)(=O)=O)c(c3)[N+]([O-])=O)c(Oc3cc4cc[nH]c4cc3F)c2)=C(C1)c1ccc(Cl)cc1 |c:61|
BDBM145175 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(NCC4CCOCC4)c(c3)[N+]([O-])=O)c(Oc3cnc(N)c(c3)C3CC3)c2)=C(C1)c1ccc(Cl)cc1 |c:58|
BDBM145176 COC1CCC(CNc2ccc(cc2[N+]([O-])=O)S(=O)(=O)NC(=O)c2ccc(cc2Oc2cnc(N)c(Br)c2)N2CCN(CC3=C(CC(C)(C)CC3)c3ccc(Cl)cc3)CC2)CC1 |t:46,(-11.47,3.54,;-10.7,2.21,;-9.16,2.21,;-8.39,.88,;-6.85,.88,;-6.08,2.21,;-4.54,2.21,;-3.77,3.54,;-2.23,3.54,;-1.46,2.21,;.08,2.21,;.85,3.54,;.08,4.88,;-1.46,4.88,;-2.23,6.21,;-1.46,7.54,;-3.77,6.21,;2.39,3.54,;2.39,5.08,;3.93,3.54,;2.39,2,;3.72,1.23,;5.06,2,;3.72,-.31,;5.06,-1.08,;5.06,-2.62,;3.72,-3.39,;2.39,-2.62,;2.39,-1.08,;1.06,-.31,;-.28,-1.08,;-1.61,-.31,;-2.94,-1.08,;-2.94,-2.62,;-4.28,-3.39,;-1.61,-3.39,;-1.61,-4.93,;-.28,-2.62,;3.72,-4.93,;5.06,-5.7,;5.06,-7.24,;3.72,-8.01,;3.72,-9.55,;5.06,-10.32,;5.06,-11.86,;6.39,-12.63,;7.73,-11.86,;8.54,-13.16,;9.26,-11.91,;7.73,-10.32,;6.39,-9.55,;3.72,-12.63,;3.72,-14.17,;2.39,-14.94,;1.06,-14.17,;-.28,-14.94,;1.06,-12.63,;2.39,-11.86,;2.39,-7.24,;2.39,-5.7,;-6.85,3.54,;-8.39,3.54,)|
BDBM145177 Cn1c2c(Oc3cc(ccc3C(=O)NS(=O)(=O)c3ccc(NCC4CCOCC4)c(c3)[N+]([O-])=O)N3CCN(CC4=C(CC(C)(C)CC4)c4ccc(Cl)cc4)CC3)cccc2[nH]c1=O |t:42|
BDBM145129 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(NC4CCC(CC4)N4CCOCC4)c(c3)[N+]([O-])=O)c(Oc3cccc4NC(=O)Cc34)c2)=C(C1)c1ccc(Cl)cc1 |c:64,(17.17,-3.13,;15.63,-3.18,;16.44,-1.87,;14.29,-2.41,;12.96,-3.18,;12.96,-4.72,;11.63,-5.49,;10.29,-4.72,;10.29,-3.18,;8.96,-2.41,;7.62,-3.18,;7.62,-4.72,;8.96,-5.49,;6.29,-2.41,;6.29,-.87,;4.96,-.1,;3.62,-.87,;2.29,-.1,;.96,-.87,;2.29,1.44,;.96,2.21,;1.73,3.54,;.19,.88,;-.38,2.98,;-1.71,2.21,;-3.05,2.98,;-3.05,4.52,;-4.38,5.29,;-5.71,4.52,;-5.71,2.98,;-7.05,2.21,;-8.38,2.98,;-8.38,4.52,;-7.05,5.29,;-9.71,2.21,;-9.71,.67,;-11.05,-.1,;-12.38,.67,;-12.38,2.21,;-11.05,2.98,;-1.71,5.29,;-.38,4.52,;-1.71,6.83,;-3.05,7.6,;-.38,7.6,;3.62,-2.41,;2.29,-3.18,;2.29,-4.72,;3.62,-5.49,;3.62,-7.03,;2.29,-7.8,;.96,-7.03,;-.51,-7.5,;-1.41,-6.26,;-2.95,-6.26,;-.51,-5.01,;.96,-5.49,;4.96,-3.18,;14.29,-5.49,;15.63,-4.72,;14.29,-7.03,;15.63,-7.8,;15.63,-9.34,;14.29,-10.11,;14.29,-11.65,;12.96,-9.34,;12.96,-7.8,)|
BDBM145130 COCCNc1ccc(cc1[N+]([O-])=O)S(=O)(=O)NC(=O)c1ccc(cc1Oc1cccc2NC(=O)Cc12)N1CCN(CC2=C(CC(C)(C)CC2)c2ccc(Cl)cc2)CC1 |t:46|
BDBM145131 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3cnc(OCC4CCOCC4)c(c3)C#C)c(Oc3cc4cc[nH]c4cc3F)c2)=C(C1)c1ccc(Cl)cc1 |c:57|
BDBM145178 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(NCC4CN(CCO4)C4CC4)c(c3)[N+]([O-])=O)c(Oc3cnc(N)c(Cl)c3)c2)=C(C1)c1ccc(Cl)cc1 |c:59|
BDBM145179 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(N[C@@H]4CCN(C4)C4CC4)c(c3)[N+]([O-])=O)c(Oc3cnc(N)c(Cl)c3)c2)=C(C1)c1ccc(Cl)cc1 |c:57|
BDBM145180 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(OCC4(F)CCN(CC4)C(CF)CF)c(c3)[N+]([O-])=O)c(Oc3cnc(N)c(Cl)c3)c2)=C(C1)c1ccc(Cl)cc1 |c:61|
BDBM145132 CC1(C)CC(=C(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3cnc(OCC4CCOCC4)c(c3)C#C)c(Oc3cc4cc[nH]c4cc3F)c2)CO1)c1ccc(Cl)cc1 |t:4|
BDBM145133 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(NC4CCC(CC4)N4CCOCC4)c(c3)[N+]([O-])=O)c(Oc3cnc(N)c(Cl)c3)c2)=C(C1)c1ccc(Cl)cc1 |c:61,(10.75,-11.18,;9.94,-9.88,;11.48,-9.93,;9.94,-8.34,;8.6,-7.57,;7.27,-8.34,;5.94,-7.57,;5.94,-6.03,;7.27,-5.26,;7.27,-3.72,;5.94,-2.95,;4.6,-3.72,;4.6,-5.26,;5.94,-1.41,;7.27,-.64,;7.27,.9,;5.94,1.67,;5.94,3.21,;7.27,3.98,;4.6,3.98,;4.6,5.52,;4.6,7.06,;6.14,5.52,;3.06,5.52,;2.29,4.19,;.75,4.19,;-.02,5.52,;-1.56,5.52,;-2.33,4.19,;-1.56,2.85,;-2.33,1.52,;-3.87,1.52,;-4.64,2.85,;-3.87,4.19,;-4.64,.19,;-3.87,-1.15,;-4.64,-2.48,;-6.18,-2.48,;-6.95,-1.15,;-6.18,.19,;.75,6.86,;2.29,6.86,;-.02,8.19,;.75,9.52,;-1.56,8.19,;4.6,.9,;3.27,1.67,;1.94,.9,;.6,1.67,;-.73,.9,;-.73,-.64,;-2.06,-1.41,;.6,-1.41,;.6,-2.95,;1.94,-.64,;4.6,-.64,;7.27,-9.88,;8.6,-10.65,;5.94,-10.65,;5.94,-12.19,;4.6,-12.96,;3.27,-12.19,;1.94,-12.96,;3.27,-10.65,;4.6,-9.88,)|
BDBM145134 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3cnc(OC4CCN(CC4)C4CCOCC4)c(c3)C#N)c(Oc3cc4cc[nH]c4cc3F)c2)=C(C1)c1ccc(Cl)cc1 |c:63|
BDBM145181 CC(C)(C)OC(=O)Nc1cc(Oc2cc(ccc2C(=O)NS(=O)(=O)c2ccc(NCC3CCOCC3)c(c2)[N+]([O-])=O)N2CCN(CC3=C(CC(C)(C)CC3)c3ccc(Cl)cc3)CC2)cc(Br)n1 |t:49|
BDBM145182 CC(C)(C)OC(=O)Nc1cc(Oc2cc(ccc2C(=O)NS(=O)(=O)c2ccc(NCC3CCOCC3)c(c2)[N+]([O-])=O)N2CCN(CC3=C(CC(C)(C)CC3)c3ccc(Cl)cc3)CC2)cc(NC(=O)OC(C)(C)C)n1 |t:49|
BDBM145183 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(NCC4CCOCC4)c(c3)[N+]([O-])=O)c(Oc3ccc(NC4CC4)nc3)c2)=C(C1)c1ccc(Cl)cc1 |c:58|
BDBM145135 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3cnc(OCC4(F)CCOCC4)c(Cl)c3)c(Oc3cc4cc[nH]c4cc3F)c2)=C(C1)c1ccc(Cl)cc1 |c:57|
BDBM145136 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(NC4CCN(CC4)C4CC4)c(c3)[N+]([O-])=O)c(Oc3cc4cc[nH]c4cc3F)c2)=C(C1)c1ccc(Cl)cc1 |c:61|
BDBM145137 CCN1CCOCC1COc1ccc(cc1[N+]([O-])=O)S(=O)(=O)NC(=O)c1ccc(cc1Oc1cc2cc[nH]c2cc1F)N1CCN(CC2=C(CC(C)(C)CC2)c2ccc(Cl)cc2)CC1 |t:52|
BDBM145184 COC1CCC(CNc2ccc(cc2[N+]([O-])=O)S(=O)(=O)NC(=O)c2ccc(cc2Oc2ccc(NCC(F)F)nc2)N2CCN(CC3=C(CC(C)(C)CC3)c3ccc(Cl)cc3)CC2)CC1 |t:49,(10.41,3.99,;9.64,5.32,;8.1,5.32,;7.33,6.65,;5.79,6.65,;5.02,5.32,;3.48,5.32,;2.71,3.99,;1.17,3.99,;.4,5.32,;-1.14,5.32,;-1.91,3.99,;-1.14,2.65,;.4,2.65,;1.17,1.32,;2.71,1.32,;1.8,-.09,;-3.45,3.99,;-3.45,5.53,;-4.99,3.99,;-3.45,2.45,;-2.11,1.68,;-.61,2,;-2.11,.14,;-3.45,-.63,;-3.45,-2.17,;-2.11,-2.94,;-.78,-2.17,;-.78,-.63,;.55,.14,;1.89,-.63,;3.22,.14,;4.56,-.63,;4.56,-2.17,;5.89,-2.94,;7.22,-2.17,;8.56,-2.94,;9.89,-2.17,;8.56,-4.48,;3.22,-2.94,;1.89,-2.17,;-2.11,-4.48,;-.78,-5.25,;-.78,-6.79,;-2.11,-7.56,;-2.11,-9.1,;-3.45,-9.87,;-3.45,-11.41,;-4.78,-12.18,;-6.11,-11.41,;-6.93,-12.72,;-7.65,-11.47,;-6.11,-9.87,;-4.78,-9.1,;-2.11,-12.18,;-.78,-11.41,;.55,-12.18,;.55,-13.72,;1.89,-14.49,;-.78,-14.49,;-2.11,-13.72,;-3.45,-6.79,;-3.45,-5.25,;5.79,3.99,;7.33,3.99,)|
BDBM145185 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(NCC4CCOCC4)c(c3)[N+]([O-])=O)c(Oc3ccc(NCC(F)F)nc3)c2)=C(C1)c1ccc(Cl)cc1 |c:58|
BDBM145186 CNc1ncc(Oc2cc(ccc2C(=O)NS(=O)(=O)c2ccc(NCC3CCOCC3)c(c2)[N+]([O-])=O)N2CCN(CC3=C(CC(C)(C)CC3)c3ccc(Cl)cc3)CC2)cc1Cl |t:44|
BDBM161595 C[C@@H]1Cc2ccccc2CN1C(=O)c1ccc(Cl)cc1-c1cc(C(=O)N(c2cnn(C)c2)c2ccc(O)cc2)c(C)n1CCN1CCOCC1
BDBM161596 Cc1c(cc(C#N)n1C)N(C(=O)c1cc(-c2cc(Cl)ccc2C(=O)N2Cc3ccccc3C[C@H]2CCCN2CCOCC2)n(C)c1C)c1ccc(O)cc1
BDBM161597 Cc1c(cc(C#N)n1C)N(C(=O)c1cc(-c2cc3OCCOc3cc2C(=O)N2Cc3ccccc3C[C@H]2CN2CCOCC2)n(C)c1C)c1ccc(O)cc1
BDBM145138 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(N[C@H]4CCCN(C4)C4CCOCC4)c(c3)[N+]([O-])=O)c(Oc3cc4cc[nH]c4cc3F)c2)=C(C1)c1ccc(Cl)cc1 |c:64|
BDBM145139 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(OCC4(F)CCOCC4)c(c3)[N+]([O-])=O)c(Oc3cnc(N)c(Cl)c3)c2)=C(C1)c1ccc(Cl)cc1 |c:56|
BDBM145140 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(NN4CCS(=O)(=O)CC4)c(c3)[N+]([O-])=O)c(Oc3cc4cc[nH]c4cc3F)c2)=C(C1)c1ccc(Cl)cc1 |c:59|
BDBM145187 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(NCC4CN(CCO4)C(CF)CF)c(c3)[N+]([O-])=O)c(Oc3cnc(N)c(Cl)c3)c2)=C(C1)c1ccc(Cl)cc1 |c:60|
BDBM145188 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(NCC4CCOCC4)c(c3)[N+]([O-])=O)c(Oc3cc(N)nc(Br)c3)c2)=C(C1)c1ccc(Cl)cc1 |c:55|
BDBM145190 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(OCC4CCOCC4)c(c3)[N+]([O-])=O)c(Oc3cnc(N)c(Cl)c3)c2)=C(C1)c1ccc(Cl)cc1 |c:55|
BDBM145189 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(NCC4CCOCC4)c(c3)[N+]([O-])=O)c(Oc3cc(N)nc(N)c3)c2)=C(C1)c1ccc(Cl)cc1 |c:55|
BDBM161601 COc1ccc(-c2cc(C(=O)N(c3cnn(C)c3)c3ccc(O)cc3)c(C)n2C)c(c1)C(=O)N1Cc2ccccc2C[C@H]1CN1CCOCC1
BDBM145141 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(NCC4CCOC4)c(c3)[N+]([O-])=O)c(Oc3cc4cc[nH]c4cc3F)c2)=C(C1)c1ccc(Cl)cc1 |c:57|
BDBM145142 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3cnc(OC4CCC(CC4)N4CCOCC4)c(Br)c3)c(Oc3cc4cc[nH]c4cc3F)c2)=C(C1)c1ccc(Cl)cc1 |c:62,(.55,-12.15,;1.37,-10.84,;-.17,-10.89,;1.37,-9.3,;2.7,-8.53,;4.03,-9.3,;5.37,-8.53,;5.37,-6.99,;6.7,-6.22,;6.7,-4.68,;5.37,-3.91,;4.03,-4.68,;4.03,-6.22,;5.37,-2.37,;6.7,-1.6,;6.7,-.06,;5.37,.71,;5.37,2.25,;6.7,3.02,;4.03,3.02,;4.03,4.56,;2.49,4.56,;5.57,4.56,;4.03,6.1,;5.37,6.87,;5.37,8.41,;4.03,9.18,;4.03,10.72,;5.37,11.49,;5.37,13.03,;6.7,13.8,;8.03,13.03,;8.03,11.49,;6.7,10.72,;9.37,13.8,;9.37,15.34,;10.7,16.11,;12.03,15.34,;12.03,13.8,;10.7,13.03,;2.7,8.41,;1.37,9.18,;2.7,6.87,;4.03,-.06,;2.7,.71,;1.37,-.06,;.03,.71,;-1.3,-.06,;-2.77,.42,;-3.67,-.83,;-2.77,-2.08,;-1.3,-1.6,;.03,-2.37,;1.37,-1.6,;2.7,-2.37,;4.03,-1.6,;4.03,-10.84,;2.7,-11.61,;5.37,-11.61,;6.7,-10.84,;8.03,-11.61,;8.03,-13.15,;9.37,-13.92,;6.7,-13.92,;5.37,-13.15,)|
BDBM145191 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(N[C@@H]4CCCN(C4)C(CF)CF)c(c3)[N+]([O-])=O)c(Oc3cnc(N)c(Cl)c3)c2)=C(C1)c1ccc(Cl)cc1 |c:59|
BDBM145192 CC(C)(C)OC(=O)Nc1cc(Oc2cc(ccc2C(=O)NS(=O)(=O)c2ccc(NCC3CCOCC3)c(c2)[N+]([O-])=O)N2CCN(CC3=C(CC(C)(C)CC3)c3ccc(Cl)cc3)CC2)c(Br)cn1 |t:49|
BDBM145193 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(NCC4CCOCC4)c(c3)[N+]([O-])=O)c(Oc3cnc4[nH]ccc4c3Cl)c2)=C(C1)c1ccc(Cl)cc1 |c:58|
BDBM145124 [O-][N+](=O)c1cc(ccc1NC1CCC(CC1)N1CCOCC1)S(=O)(=O)NC(=O)c1ccc(cc1Oc1cc2cc[nH]c2cc1Cl)N1CCN(CC2=C(CCOCC2)c2ccc(Cl)cc2)CC1 |t:56,(.97,8.56,;2.3,9.33,;2.3,10.87,;3.63,8.56,;3.63,7.02,;4.97,6.25,;6.3,7.02,;6.3,8.56,;4.97,9.33,;4.97,10.87,;6.3,11.64,;6.3,13.18,;7.63,13.95,;8.97,13.18,;8.97,11.64,;7.63,10.87,;10.3,13.95,;10.3,15.49,;11.63,16.26,;12.97,15.49,;12.97,13.95,;11.63,13.18,;4.97,4.71,;6.51,4.71,;3.43,4.71,;4.97,3.17,;3.63,2.4,;2.3,3.17,;3.63,.86,;4.97,.09,;4.97,-1.45,;3.63,-2.22,;2.3,-1.45,;2.3,.09,;.97,.86,;-.37,.09,;-1.7,.86,;-3.04,.09,;-4.5,.57,;-5.41,-.68,;-4.5,-1.93,;-3.04,-1.45,;-1.7,-2.22,;-.37,-1.45,;.97,-2.22,;3.63,-3.76,;4.97,-4.53,;4.97,-6.07,;3.63,-6.84,;3.63,-8.38,;2.3,-9.15,;2.41,-10.69,;1.29,-11.73,;-.24,-11.5,;-1.01,-10.17,;-.45,-8.74,;1.03,-8.28,;3.85,-11.25,;5.05,-10.29,;6.49,-10.85,;6.71,-12.37,;8.15,-12.94,;5.51,-13.33,;4.08,-12.77,;2.3,-6.07,;2.3,-4.53,)|
BDBM145125 CN1CCN(CC1)Nc1ccc(cc1[N+]([O-])=O)S(=O)(=O)NC(=O)c1ccc(cc1Oc1cc2cc[nH]c2cc1F)N1CCN(CC2=C(CC(C)(C)OC2)c2ccc(Cl)cc2)CC1 |t:50|
BDBM145143 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(NC4CCC(CC4)N(C4CC4)C4CC4)c(c3)[N+]([O-])=O)c(Oc3cc4cc[nH]c4cc3F)c2)=C(C1)c1ccc(Cl)cc1 |c:66,(-8.81,14.66,;-8.09,13.3,;-7.37,14.66,;-6.76,12.53,;-6.76,10.99,;-8.09,10.22,;-8.09,8.68,;-6.76,7.91,;-6.76,6.37,;-5.42,5.6,;-4.09,6.37,;-4.09,7.91,;-5.42,8.68,;-2.76,5.6,;-1.42,6.37,;-.09,5.6,;-.09,4.06,;1.25,3.29,;1.25,1.75,;2.58,4.06,;3.91,3.29,;4.68,4.62,;3.14,1.95,;5.25,2.52,;5.25,.98,;6.58,.21,;7.91,.98,;9.25,.21,;9.25,-1.33,;10.58,-2.1,;10.58,-3.64,;9.25,-4.41,;7.91,-3.64,;7.91,-2.1,;9.25,-5.95,;7.91,-6.72,;7.14,-8.06,;6.37,-6.72,;10.58,-6.72,;12.12,-6.72,;11.35,-8.06,;7.91,2.52,;6.58,3.29,;9.25,3.29,;10.58,2.52,;9.25,4.83,;-1.42,3.29,;-1.42,1.75,;-2.76,.98,;-4.09,1.75,;-5.42,.98,;-6.89,1.45,;-7.79,.21,;-6.89,-1.04,;-5.42,-.56,;-4.09,-1.33,;-2.76,-.56,;-1.42,-1.33,;-2.76,4.06,;-9.42,10.99,;-9.42,12.53,;-10.76,10.22,;-10.76,8.68,;-12.09,7.91,;-13.42,8.68,;-14.76,7.91,;-13.42,10.22,;-12.09,10.99,)|
BDBM145144 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(NC4CCC(CC4)NC4CCOCC4)c(c3)[N+]([O-])=O)c(Oc3cc4cc[nH]c4cc3F)c2)=C(C1)c1ccc(Cl)cc1 |c:65,(-6.22,13.89,;-5.5,12.53,;-4.77,13.89,;-4.16,11.76,;-4.16,10.22,;-5.5,9.45,;-5.5,7.91,;-4.16,7.14,;-4.16,5.6,;-2.83,4.83,;-1.49,5.6,;-1.49,7.14,;-2.83,7.91,;-.16,4.83,;1.17,5.6,;2.51,4.83,;2.51,3.29,;3.84,2.52,;3.84,.98,;5.17,3.29,;6.51,2.52,;7.28,3.85,;5.74,1.19,;7.84,1.75,;7.84,.21,;9.17,-.56,;10.51,.21,;11.84,-.56,;11.84,-2.1,;13.18,-2.87,;13.18,-4.41,;11.84,-5.18,;10.51,-4.41,;10.51,-2.87,;11.84,-6.72,;10.51,-7.49,;9.17,-6.72,;7.84,-7.49,;7.84,-9.03,;9.17,-9.8,;10.51,-9.03,;10.51,1.75,;9.17,2.52,;11.84,2.52,;13.18,1.75,;11.84,4.06,;1.17,2.52,;1.17,.98,;-.16,.21,;-1.49,.98,;-2.83,.21,;-4.29,.69,;-5.2,-.56,;-4.29,-1.81,;-2.83,-1.33,;-1.49,-2.1,;-.16,-1.33,;1.17,-2.1,;-.16,3.29,;-6.83,10.22,;-6.83,11.76,;-8.16,9.45,;-8.16,7.91,;-9.5,7.14,;-10.83,7.91,;-12.16,7.14,;-10.83,9.45,;-9.5,10.22,)|
BDBM145194 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(NCC4CCOCC4)c(c3)[N+]([O-])=O)c(Oc3ccc(NCC(F)(F)F)nc3)c2)=C(C1)c1ccc(Cl)cc1 |c:59|
BDBM145195 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(NCC4CCC(O)CC4)c(c3)[N+]([O-])=O)c(Oc3cnc(N)c(Cl)c3)c2)=C(C1)c1ccc(Cl)cc1 |c:56,(3.48,-5.93,;2.67,-4.62,;4.21,-4.67,;2.67,-3.08,;1.33,-2.31,;,-3.08,;-1.33,-2.31,;-1.33,-.77,;;,1.54,;-1.33,2.31,;-2.67,1.54,;-2.67,,;-1.33,3.85,;,4.62,;,6.16,;-1.33,6.93,;-1.33,8.47,;,9.24,;-2.67,9.24,;-2.67,10.78,;-2.67,12.32,;-1.13,10.78,;-4.21,10.78,;-4.98,9.45,;-6.52,9.45,;-7.29,10.78,;-8.83,10.78,;-9.6,9.45,;-11.14,9.45,;-11.91,8.11,;-13.45,8.11,;-14.22,9.45,;-15.76,9.45,;-13.45,10.78,;-11.91,10.78,;-6.52,12.11,;-4.98,12.11,;-7.29,13.45,;-6.52,14.78,;-8.83,13.45,;-2.67,6.16,;-4,6.93,;-5.33,6.16,;-6.67,6.93,;-8,6.16,;-8,4.62,;-9.34,3.85,;-6.67,3.85,;-6.67,2.31,;-5.33,4.62,;-2.67,4.62,;,-4.62,;1.33,-5.39,;-1.33,-5.39,;-1.33,-6.93,;-2.67,-7.7,;-4,-6.93,;-5.33,-7.7,;-4,-5.39,;-2.67,-4.62,)|
BDBM145196 CC1(C)CC(=C(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(NCC4CCOCC4)c(c3)[N+]([O-])=O)c(Oc3cnc(N)c(Cl)c3)c2)CO1)c1ccc(Cl)cc1 |t:4|
BDBM145145 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(NC4CCC(CC4)N4CCN(CC4)C4CCOCC4)c(c3)[N+]([O-])=O)c(Oc3cc4cc[nH]c4cc3F)c2)=C(C1)c1ccc(Cl)cc1 |c:71,(-7.99,-9.64,;-7.17,-8.33,;-8.71,-8.39,;-7.17,-6.79,;-5.84,-6.02,;-4.5,-6.79,;-3.17,-6.02,;-3.17,-4.48,;-1.84,-3.71,;-1.84,-2.17,;-3.17,-1.4,;-4.5,-2.17,;-4.5,-3.71,;-3.17,.14,;-1.84,.91,;-1.84,2.45,;-3.17,3.22,;-3.17,4.76,;-4.5,5.53,;-1.84,5.53,;-1.84,7.07,;-.3,7.07,;-3.38,7.07,;-1.84,8.61,;-.5,9.38,;-.5,10.92,;-1.84,11.69,;-1.84,13.23,;-.5,14,;-.5,15.54,;.83,16.31,;2.17,15.54,;2.17,14,;.83,13.23,;3.5,16.31,;3.5,17.85,;4.83,18.62,;6.17,17.85,;6.17,16.31,;4.83,15.54,;7.5,18.62,;8.83,17.85,;10.17,18.62,;10.17,20.16,;8.83,20.93,;7.5,20.16,;-3.17,10.92,;-3.17,9.38,;-4.5,11.69,;-5.84,10.92,;-4.5,13.23,;-4.5,2.45,;-5.84,3.22,;-7.17,2.45,;-8.5,3.22,;-9.84,2.45,;-11.3,2.92,;-12.21,1.68,;-11.3,.43,;-9.84,.91,;-8.5,.14,;-7.17,.91,;-5.84,.14,;-4.5,.91,;-4.5,-8.33,;-5.84,-9.1,;-3.17,-9.1,;-1.84,-8.33,;-.5,-9.1,;-.5,-10.64,;.83,-11.41,;-1.84,-11.41,;-3.17,-10.64,)|
BDBM145146 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(NCC4(F)CCOCC4)c(c3)[N+]([O-])=O)c(Oc3cc4cc[nH]c4cc3F)c2)=C(C1)c1ccc(Cl)cc1 |c:59|
BDBM145197 CC1(C)CC(=C(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3cnc(OCC4(F)CCOCC4)c(Cl)c3)c(Oc3cc4cc[nH]c4cc3F)c2)CO1)c1ccc(Cl)cc1 |t:4|
BDBM145198 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(NCC4CCOC4)c(c3)[N+]([O-])=O)c(Oc3cnc(N)c(Cl)c3)c2)=C(C1)c1ccc(Cl)cc1 |c:54|
BDBM145199 CC1(C)CC(=C(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3cnc(OCC4(F)CCOCC4)c(Cl)c3)c(Oc3cnc(N)c(Cl)c3)c2)CO1)c1ccc(Cl)cc1 |t:4|
BDBM161581 Cc1c(cc(-c2cc3OCOc3cc2C(=O)N2Cc3ccccc3C[C@H]2CN2CCOCC2)n1C)C(=O)N(c1cnn(C)c1)c1ccc(O)c(F)c1
BDBM145147 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(NCC4CCC(O)CC4)c(c3)[N+]([O-])=O)c(Oc3cc4cc[nH]c4cc3F)c2)=C(C1)c1ccc(Cl)cc1 |c:59,(-2.92,-15.08,;-2.11,-13.78,;-3.64,-13.83,;-2.11,-12.24,;-.77,-11.47,;.56,-12.24,;1.9,-11.47,;1.9,-9.93,;3.23,-9.16,;3.23,-7.62,;1.9,-6.85,;.56,-7.62,;.56,-9.16,;1.9,-5.31,;3.23,-4.54,;3.23,-3,;1.9,-2.23,;1.9,-.69,;.56,.08,;3.23,.08,;3.23,1.62,;4.77,1.62,;1.69,1.62,;3.23,3.16,;4.56,3.93,;4.56,5.47,;3.23,6.24,;3.23,7.78,;4.56,8.55,;4.56,10.09,;3.23,10.86,;3.23,12.4,;4.56,13.17,;4.56,14.71,;5.9,12.4,;5.9,10.86,;1.9,5.47,;1.9,3.93,;.56,6.24,;-.77,5.47,;.56,7.78,;.56,-3,;-.77,-2.23,;-2.11,-3,;-3.44,-2.23,;-4.77,-3,;-6.24,-2.52,;-7.14,-3.77,;-6.24,-5.01,;-4.77,-4.54,;-3.44,-5.31,;-2.11,-4.54,;-.77,-5.31,;.56,-4.54,;.56,-13.78,;-.77,-14.55,;1.9,-14.55,;3.23,-13.78,;4.56,-14.55,;4.56,-16.09,;5.9,-16.86,;3.23,-16.86,;1.9,-16.09,)|
BDBM145148 CN(C)CCCc1c[nH]c2cccc(Oc3cc(ccc3C(=O)NS(=O)(=O)c3ccc(NCC4CCOCC4)c(c3)[N+]([O-])=O)N3CCN(CC4=C(CC(C)(C)CC4)c4ccc(Cl)cc4)CC3)c12 |t:52|
BDBM145149 CN(C)CCCc1c[nH]c2cccc(Oc3cc(ccc3C(=O)NS(=O)(=O)c3ccc(NN4CCN(C)CC4)c(c3)[N+]([O-])=O)N3CCN(CC4=C(CC(C)(C)CC4)c4ccc(Cl)cc4)CC3)c12 |t:52|
BDBM145200 Nc1ncc(Oc2cc(ccc2C(=O)NS(=O)(=O)c2ccc(NCC3CCOCC3)c(c2)[N+]([O-])=O)N2CCN(CC3=C(CCC4(CCN(CC4)C(CF)CF)C3)c3ccc(Cl)cc3)CC2)cc1Cl |t:43|
BDBM145201 CC(C)N1CCC2(CC1)CCC(=C(CN1CCN(CC1)c1ccc(C(=O)NS(=O)(=O)c3ccc(NCC4CCOCC4)c(c3)[N+]([O-])=O)c(Oc3cnc(N)c(Cl)c3)c1)C2)c1ccc(Cl)cc1 |t:12|
BDBM145202 CN(C)CC(=O)N1CCC(F)(COc2ncc(cc2Cl)S(=O)(=O)NC(=O)c2ccc(cc2Oc2cnc(N)c(Cl)c2)N2CCN(CC3=C(CC(C)(C)CC3)c3ccc(Cl)cc3)CC2)CC1 |t:49|
BDBM145150 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(OCC4(F)CCN(CC4)C4CC4)c(c3)[N+]([O-])=O)c(Oc3cc4cc[nH]c4cc3F)c2)=C(C1)c1ccc(Cl)cc1 |c:63|
BDBM145151 COc1ccc(Cn2nnc3c(Oc4cc(ccc4C(=O)NS(=O)(=O)c4ccc(NCC5CCOCC5)c(c4)[N+]([O-])=O)N4CCN(CC5=C(CC(C)(C)CC5)c5ccc(Cl)cc5)CC4)cccc23)cc1 |t:50|
BDBM145152 CN1CCN(CC1)Nc1ccc(cc1[N+]([O-])=O)S(=O)(=O)NC(=O)c1ccc(cc1Oc1cnc(N)c(Cl)c1)N1CCN(CC2=C(CC(C)(C)CC2)c2ccc(Cl)cc2)CC1 |t:47|
BDBM145203 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(N[C@@H]4CCN(C4)C(CF)CF)c(c3)[N+]([O-])=O)c(Oc3cnc(N)c(Cl)c3)c2)=C(C1)c1ccc(Cl)cc1 |c:58|
BDBM145204 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(NCC4CCOCC4)c(c3)[N+]([O-])=O)c(Oc3cc(N)ncc3Br)c2)=C(C1)c1ccc(Cl)cc1 |c:55|
BDBM145205 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(NCC4CCC(F)(F)CC4)c(c3)[N+]([O-])=O)c(Oc3cnc(N)c(Cl)c3)c2)=C(C1)c1ccc(Cl)cc1 |c:57|
BDBM161598 Cc1c(cc(C#N)n1C)N(C(=O)c1cc(-c2cc(Cl)ccc2C(=O)N2Cc3ccccc3C[C@H]2CN2CCOCC2)n(C)c1)c1ccc(O)cc1
BDBM145153 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(OCC4COCCO4)c(c3)[N+]([O-])=O)c(Oc3cnc(N)c(Cl)c3)c2)=C(C1)c1ccc(Cl)cc1 |c:55|
BDBM145154 COC1CCC(CNc2ccc(cc2[N+]([O-])=O)S(=O)(=O)NC(=O)c2ccc(cc2Oc2cnc(N)c(Cl)c2)N2CCN(CC3=C(CC(C)(C)CC3)c3ccc(Cl)cc3)CC2)CC1 |t:46,(-11.47,3.54,;-10.7,2.21,;-9.16,2.21,;-8.39,.88,;-6.85,.88,;-6.08,2.21,;-4.54,2.21,;-3.77,3.54,;-2.23,3.54,;-1.46,2.21,;.08,2.21,;.85,3.54,;.08,4.88,;-1.46,4.88,;-2.23,6.21,;-1.46,7.54,;-3.77,6.21,;2.39,3.54,;2.39,5.08,;3.93,3.54,;2.39,2,;3.72,1.23,;5.06,2,;3.72,-.31,;5.06,-1.08,;5.06,-2.62,;3.72,-3.39,;2.39,-2.62,;2.39,-1.08,;1.06,-.31,;-.28,-1.08,;-1.61,-.31,;-2.94,-1.08,;-2.94,-2.62,;-4.28,-3.39,;-1.61,-3.39,;-1.61,-4.93,;-.28,-2.62,;3.72,-4.93,;5.06,-5.7,;5.06,-7.24,;3.72,-8.01,;3.72,-9.55,;5.06,-10.32,;5.06,-11.86,;6.39,-12.63,;7.73,-11.86,;8.54,-13.16,;9.26,-11.91,;7.73,-10.32,;6.39,-9.55,;3.72,-12.63,;3.72,-14.17,;2.39,-14.94,;1.06,-14.17,;-.28,-14.94,;1.06,-12.63,;2.39,-11.86,;2.39,-7.24,;2.39,-5.7,;-6.85,3.54,;-8.39,3.54,)|
BDBM145155 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(NCC4COCCO4)c(c3)[N+]([O-])=O)c(Oc3cnc(N)c(Cl)c3)c2)=C(C1)c1ccc(Cl)cc1 |c:55|
BDBM145206 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(NCC4CCOCC4)c(c3)[N+]([O-])=O)c(Oc3cc(Cl)c(=N)n(COP(O)(O)=O)c3)c2)=C(C1)c1ccc(Cl)cc1 |c:61|
BDBM145207 CN(C)CCOc1cccc(c1CN1CCN(CC1)c1ccc(C(=O)NS(=O)(=O)c2ccc(NCC3CCOCC3)c(c2)[N+]([O-])=O)c(Oc2cnc(N)c(Cl)c2)c1)-c1ccc(Cl)cc1
BDBM145208 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3cnc(OC[C@@H]4CCN(C4)C(CF)CF)c(Cl)c3)c(Oc3cnc(N)c(Cl)c3)c2)=C(C1)c1ccc(Cl)cc1 |c:57|
BDBM47132 CC(C)(C)OC(=O)Oc1cc(ccc1C(=O)NS(=O)(=O)c1ccc(NCC2CCOCC2)c(c1)[N+]([O-])=O)N1CCc2c(C1)cccc2N1CCN(CC2=C(CC(C)(C)CC2)c2ccc(Cl)cc2)CC1 |t:57|
BDBM145112 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3cnc(OCC4CCOCC4)c(Cl)c3)c(Oc3cc4cc[nH]c4cc3F)c2)=C(C1)c1ccc(Cl)cc1 |c:56|
BDBM161604 Cc1c(cc(C#N)n1C)N(C(=O)c1cc(-c2cc(F)ccc2C(=O)N2Cc3ccccc3C[C@H]2CN2CCOCC2)n(C)c1C)c1ccc(O)cc1
BDBM161605 Cc1c(cc(-c2ccccc2C(=O)N2Cc3ccccc3C[C@H]2CN2CCOCC2)n1C)C(=O)N(c1cnn(C)c1)c1ccc(O)cc1
BDBM161606 Cc1c(cc(-c2cc(F)ccc2C(=O)N2Cc3ccccc3C[C@H]2CN2CCOCC2)n1C)C(=O)N(c1cnn(c1)C1COC1)c1ccc(O)cc1
BDBM161621 Cc1c(cc(-c2cc(Cl)ccc2C(=O)N2Cc3ccccc3C[C@H]2CN2CCOCC2)n1C)C(=O)N(c1ccc(O)cc1)c1cnccn1
BDBM161619 Cc1c(cc(-c2cc(Cl)ccc2C(=O)N2Cc3ccccc3C[C@H]2CN2CCOCC2)n1C)C(=O)N(c1ccc(s1)C#N)c1ccc(O)cc1
BDBM161620 Cc1c(cc(-c2cc(F)ccc2C(=O)N2Cc3ccccc3C[C@H]2CN2CCOCC2)n1C)C(=O)N(c1ccc(O)cc1)c1ccc(F)c(c1)C#N
BDBM161608 COc1cc(cc(c1)N(C(=O)c1cc(-c2cc(F)ccc2C(=O)N2Cc3ccccc3C[C@H]2CN2CCOCC2)n(C)c1C)c1ccc(O)cc1)C#N
BDBM161607 COc1ncc(cn1)N(C(=O)c1cc(-c2ccccc2C(=O)N2Cc3ccccc3C[C@H]2CN2CCOCC2)n(C)c1C)c1ccc(O)cc1
BDBM161622 COc1ncc(cn1)N(C(=O)c1cc(-c2cc(F)c(OC)cc2C(=O)N2Cc3ccccc3C[C@H]2CN2CCOCC2)n(C)c1C)c1ccc(O)cc1
BDBM161623 COc1cc(C(=O)N2Cc3ccccc3C[C@H]2CN2CCOCC2)c(cc1F)-c1cc(C(=O)N(c2cc(C#N)n(C)c2C)c2ccc(O)cc2)c(C)n1C
BDBM161624 Cc1c(cc(C#N)n1C)N(C(=O)c1cc(-c2cc(Cl)ccc2C(=O)N2Cc3ccccc3C[C@H]2CN2CCOCC2)n(C)c1C)c1ccccc1
BDBM161625 Cc1c(cc(-c2cc(Cl)ccc2C(=O)N2Cc3ccccc3C[C@H]2CN2CCOCC2)n1C)C(=O)N(c1csc(c1)C#N)c1ccc(O)cc1
BDBM161609 COc1ncc(cn1)N(C(=O)c1cc(-c2cc(F)ccc2C(=O)N2Cc3ccccc3C[C@H]2CN2CCOCC2)n(C)c1C)c1ccc(O)cc1
BDBM161610 COc1ccc(cc1C#N)N(C(=O)c1cc(-c2cc(F)ccc2C(=O)N2Cc3ccccc3C[C@H]2CN2CCOCC2)n(C)c1C)c1ccc(O)cc1
BDBM161611 Cc1c(cc(C#N)n1C)N(C(=O)c1cc(-c2ccc(F)cc2C(=O)N2Cc3ccccc3C[C@H]2CN2CCOCC2)n(C)c1C)c1ccc(O)cc1
BDBM161627 COc1cnc(cn1)N(C(=O)c1cc(-c2cc(Cl)ccc2C(=O)N2Cc3ccccc3C[C@H]2CN2CCOCC2)n(C)c1C)c1ccc(O)cc1
BDBM161628 Cc1c(cc(-c2cc(Cl)ccc2C(=O)N2Cc3ccccc3C[C@H]2CN2CCOCC2)n1C)C(=O)N(c1ccc(O)cc1)c1cnc(F)cn1
BDBM161612 COc1cc(-c2cc(C(=O)N(c3cc(C#N)n(C)c3C)c3ccc(O)cc3)c(C)n2C)c(cc1F)C(=O)N1Cc2ccccc2C[C@H]1CN1CCOCC1
BDBM161613 Cc1c(cc(-c2cc(Cl)ccc2C(=O)N2Cc3ccccc3CC2C(F)(F)F)n1C)C(=O)N(c1ccc(O)cc1)c1cnc2n(C)ccc2c1
BDBM161631 Cc1c(cc(-c2cc(Cl)ccc2C(=O)N2Cc3ccccc3C[C@H]2CN2CCOCC2)n1C)C(=O)N(c1cc(nn1C)C#N)c1ccc(O)cc1
BDBM161632 Cc1c(cc(-c2cc(F)ccc2C(=O)N2Cc3ccccc3C[C@H]2CN2CCOCC2)n1C)C(=O)N(c1ccc(O)cc1)c1cnc2n(C)ncc2c1
BDBM161633 Cc1nn(C)cc1N(C(=O)c1cc(-c2cc(F)ccc2C(=O)N2Cc3ccccc3C[C@H]2CN2CCOCC2)n(C)c1C)c1ccc(O)cc1
BDBM50030751 CN(C)CC#Cc1cc(F)c(OCCCc2sc(nc2C(O)=O)N2CCc3cccc(C(=O)Nc4nc5ccccc5s4)c3C2)cc1F
BDBM50030752 CN(C)CC#Cc1ccc(OCCCc2sc(nc2C(O)=O)N2CCc3cccc(C(=O)Nc4nc5ccccc5s4)c3C2)cc1F
BDBM50030754 CN(C)CC#Cc1ccc(OCCCc2sc(nc2C(O)=O)N2CCc3cccc(C(=O)Nc4nc5ccccc5s4)c3C2)c(F)c1
BDBM161614 Cc1nn(C)cc1N(C(=O)c1cc(-c2cc(Cl)ccc2C(=O)N2Cc3ccccc3C[C@H]2CN2CCOCC2)n(C)c1C)c1ccc(O)cc1
BDBM161615 Cc1c(cnn1C)N(C(=O)c1cc(-c2cc(Cl)ccc2C(=O)N2Cc3ccccc3C[C@H]2CN2CCOCC2)n(C)c1C)c1ccc(O)cc1
BDBM161634 Cc1c(cnn1C)N(C(=O)c1cc(-c2cc(F)ccc2C(=O)N2Cc3ccccc3C[C@H]2CN2CCOCC2)n(C)c1C)c1ccc(O)cc1
BDBM161635 Cc1c(cc(C#N)n1C)N(C(=O)c1cc(-c2cc(Cl)ccc2C(=O)N2Cc3ccccc3CC2C(F)(F)F)n(C)c1C)c1ccc(O)cc1
BDBM161636 C[C@@H]1Cc2ccccc2CN1C(=O)c1ccc(Cl)cc1-c1cc(C(=O)N(c2cc(C#N)n(CCN3CCOCC3)c2C)c2ccc(O)cc2)c(C)n1C
BDBM161637 C[C@@H]1Cc2ccccc2CN1C(=O)c1ccc(Cl)cc1-c1cc(C(=O)N(c2ccc(O)cc2)c2cnc(OCCN3CCOCC3)nc2)c(C)n1C
BDBM50030756 CN(C)CC#Cc1ccc(OCCCc2sc(nc2C(O)=O)N2CCc3cccc(C(=O)Nc4nc5ccccc5s4)c3C2)cc1
BDBM50030757 CN1CCN(CCCNc2ncnc3n(ncc23)-c2ccc(OCCCc3sc(nc3C(O)=O)N3CCc4cccc(C(=O)Nc5nc6ccccc6s5)c4C3)cc2)CC1
BDBM50030758 CN(C)CCCNc1ncnc2n(ncc12)-c1ccc(OCCCc2sc(nc2C(O)=O)N2CCc3cccc(C(=O)Nc4nc5ccccc5s4)c3C2)cc1
BDBM50030759 OC(=O)c1nc(sc1CCCOc1ccc(cc1)-n1cccn1)N1CCc2cccc(C(=O)Nc3nc4ccccc4s3)c2C1
BDBM50030761 OC(=O)c1nc(sc1CCCOc1ccc(cc1)-n1ncc2cncnc12)N1CCc2cccc(C(=O)Nc3nc4ccccc4s3)c2C1
BDBM161616 Cc1c(cc(-c2ccccc2C(=O)N2Cc3ccccc3C[C@H]2CN2CCOCC2)n1C)C(=O)N(c1cc(C#N)n(C)c1)c1ccc(O)cc1
BDBM161638 Cc1c(cn(C)c1C#N)N(C(=O)c1cc(-c2cc(Cl)ccc2C(=O)N2Cc3ccccc3C[C@H]2CN2CCOCC2)n(C)c1C)c1ccc(O)cc1
BDBM161639 CCn1c(C)c(cc1C#N)N(C(=O)c1cc(-c2cc(Cl)ccc2C(=O)N2Cc3ccccc3C[C@H]2CN2CCOCC2)n(C)c1C)c1ccc(O)cc1
BDBM161640 Cc1c(cc(-c2cc(Cl)ccc2C(=O)N2Cc3ccccc3C[C@H]2CCCN2CCOCC2)n1C)C(=O)N(c1cnn(c1)C1CCOC1)c1ccc(O)cc1
BDBM161641 Cc1c(cc(C#N)n1C)N(C(=O)c1cc(-c2cc(Cl)ccc2C(=O)N2Cc3ccccc3C[C@H]2CCCN2CCOCC2)n(C)c1C)c1ccccc1
BDBM50030762 OC(=O)c1nc(sc1CCOc1ccc(cc1)-n1ncc2cncnc12)N1CCc2cccc(C(=O)Nc3nc4ccccc4s3)c2C1
BDBM161617 CN1CCc2cc(cnc12)N(C(=O)c1cc(-c2cc(F)ccc2C(=O)N2Cc3ccccc3C[C@H]2CN2CCOCC2)n(C)c1C)c1ccc(O)cc1
BDBM161642 Cc1cc(no1)N(C(=O)c1cc(-c2cc(Cl)ccc2C(=O)N2Cc3ccccc3C[C@H]2CN2CCOCC2)n(C)c1C)c1ccc(O)cc1
BDBM161644 Cc1c(cc(-c2cc(Cl)ccc2C(=O)N2Cc3ccccc3C[C@H]2CN2CCOCC2)n1C)C(=O)N(c1cnc2n(C)ccc2c1)c1ccc(O)cn1
BDBM161645 Cc1c(cc(-c2cc(Cl)ccc2C(=O)N2CCc3ccccc3C2)n1C)C(=O)N(c1ccccc1)c1ccc(O)cc1
BDBM50049521 O[C@H]1CCC(=O)c2c(O)cccc12 |r|
BDBM161618 COc1cc(C(=O)N2Cc3ccccc3C[C@H]2CN2CCOCC2)c(cc1F)-c1cc(C(=O)N(c2ccc(O)cc2)c2cc(ccn2)C#N)c(C)n1C
BDBM178741 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(NCC4CCC(O)CC4)c(c3)[N+]([O-])=O)c(Oc3ccc4[nH]ccc4c3)c2)=C(C1)c1ccc(Cl)cc1 |c:58,(8.94,-13.2,;8.12,-11.89,;9.66,-11.95,;8.12,-10.35,;6.79,-9.58,;5.46,-10.35,;4.12,-9.58,;4.12,-8.04,;5.46,-7.27,;5.46,-5.73,;4.12,-4.96,;2.79,-5.73,;2.79,-7.27,;4.12,-3.42,;5.46,-2.65,;5.46,-1.11,;4.12,-.34,;4.12,1.2,;5.46,1.97,;2.79,1.97,;2.79,3.51,;2.79,5.05,;4.33,3.51,;1.25,3.51,;.48,2.17,;-1.06,2.17,;-1.83,3.51,;-3.37,3.51,;-4.14,2.17,;-5.68,2.17,;-6.45,.84,;-7.99,.84,;-8.76,2.17,;-10.3,2.17,;-7.99,3.51,;-6.45,3.51,;-1.06,4.84,;.48,4.84,;-1.83,6.17,;-1.06,7.51,;-3.37,6.17,;2.79,-1.11,;1.46,-.34,;.12,-1.11,;.12,-2.65,;-1.21,-3.42,;-2.55,-2.65,;-4.01,-3.13,;-4.92,-1.88,;-4.01,-.64,;-2.55,-1.11,;-1.21,-.34,;2.79,-2.65,;5.46,-11.89,;6.79,-12.66,;4.12,-12.66,;4.12,-14.2,;2.79,-14.97,;1.46,-14.2,;.12,-14.97,;1.46,-12.66,;2.79,-11.89,)|
BDBM178767 [O-][N+](=O)c1cc(ccc1OCC1CCOCC1)S(=O)(=O)NC(=O)c1ccc(cc1Oc1ccc2[nH]ccc2c1)N1CCN(Cc2ccc(cc2-c2ccc(Cl)cc2)C(F)(F)F)CC1
BDBM54890 Cc1c(cc(-c2cc3OCOc3cc2C(=O)N2Cc3ccccc3C[C@H]2CN2CCOCC2)n1C)C(=O)N(c1ccccc1)c1ccc(O)cc1
BDBM50044920 FC(F)(F)S(=O)(=O)c1cc(ccc1N[C@H](CCN1CCOCC1)CSc1ccccc1)S(=O)(=O)NC(=O)c1ccc(cc1)N1CCN(Cc2ccccc2-c2ccc(Cl)cc2)CC1 |r|
BDBM50044921 FC(F)(F)S(=O)(=O)c1cc(ccc1N[C@H](CCN1CCOCC1)CSc1ccccc1)S(=O)(=O)NC(=O)c1cnc(nc1)N1CCN(Cc2ccccc2-c2ccc(Cl)cc2)CC1 |r|
BDBM50044922 [O-][S@+](C1CCN(CC1)c1ccc(cc1)C(=O)NS(=O)(=O)c1ccc(N[C@H](CCN2CCOCC2)CSc2ccccc2)c(c1)S(=O)(=O)C(F)(F)F)c1ccccc1-c1ccc(Cl)cc1 |r|
BDBM50044923 FC(F)(F)S(=O)(=O)c1cc(ccc1N[C@H](CCN1CCOCC1)CSc1ccccc1)S(=O)(=O)NC(=O)c1ccc(cc1)N1CCC(Cc2ccccc2-c2ccc(Cl)cc2)(CC1)C#N |r|
BDBM50044924 CN(C)C(=O)COc1cccc(c1CN1CCN(CC1)c1ccc(cc1)C(=O)NS(=O)(=O)c1ccc(N[C@H](CCN2CCOCC2)CSc2ccccc2)c(c1)S(=O)(=O)C(F)(F)F)-c1ccc(Cl)cc1 |r|
BDBM50044925 CN(C)C(=O)COc1ccc(c(CN2CCN(CC2)c2ccc(cc2)C(=O)NS(=O)(=O)c2ccc(N[C@H](CCN3CCOCC3)CSc3ccccc3)c(c2)S(=O)(=O)C(F)(F)F)c1)-c1ccc(Cl)cc1 |r|
BDBM50044927 CN(C)CCOc1ccc(c(CN2CCN(CC2)c2ccc(cc2)C(=O)NS(=O)(=O)c2ccc(N[C@H](CCN3CCOCC3)CSc3ccccc3)c(c2)S(=O)(=O)C(F)(F)F)c1)-c1ccc(Cl)cc1 |r|
BDBM50044930 FC(F)(F)S(=O)(=O)c1cc(ccc1N[C@H](CCN1CCOCC1)CSc1ccccc1)S(=O)(=O)NC(=O)c1ccc(nn1)N1CCN(Cc2ccccc2-c2ccc(Cl)cc2)CC1 |r|
BDBM50044931 FC(F)(F)S(=O)(=O)c1cc(ccc1N[C@H](CCN1CCOCC1)CSc1ccccc1)S(=O)(=O)NC(=O)c1csc(n1)N1CCN(Cc2ccccc2-c2ccc(Cl)cc2)CC1 |r|
BDBM50044932 FC(F)(F)S(=O)(=O)c1cc(ccc1N[C@H](CCN1CCOCC1)CSc1ccccc1)S(=O)(=O)NC(=O)c1ccc(cc1)N1CC2(CN(Cc3ccccc3-c3ccc(Cl)cc3)C2)C1 |r|
BDBM50044933 FC(F)(F)S(=O)(=O)c1cc(ccc1N[C@H](CCN1CCOCC1)CSc1ccccc1)S(=O)(=O)NC(=O)c1ccc(cc1)P1(=O)CCN(Cc2ccccc2-c2ccc(Cl)cc2)CC1 |r|
BDBM50044934 FC(F)(F)S(=O)(=O)c1cc(ccc1N[C@H](CCN1CCOCC1)CSc1ccccc1)S(=O)(=O)NC(=O)c1ccc(cc1)N1CCP(=O)(Cc2ccccc2-c2ccc(Cl)cc2)CC1 |r|
BDBM50044935 FC(F)(F)S(=O)(=O)c1cc(ccc1N[C@H](CCN1CCOCC1)CSc1ccccc1)S(=O)(=O)NC(=O)c1ccc(cc1)N1CCC(CC1)Oc1ccccc1-c1ccc(Cl)cc1 |r|
BDBM50044937 FC(F)(F)S(=O)(=O)c1cc(ccc1N[C@H](CCN1CCOCC1)CSc1ccccc1)S(=O)(=O)NC(=O)c1ccc(cc1)N1CCC(CC1)Sc1ccccc1-c1ccc(Cl)cc1 |r|
BDBM50044938 [O-][S@@+](C1CCN(CC1)c1ccc(cc1)C(=O)NS(=O)(=O)c1ccc(N[C@H](CCN2CCOCC2)CSc2ccccc2)c(c1)S(=O)(=O)C(F)(F)F)c1ccccc1-c1ccc(Cl)cc1 |r|
BDBM60406 Cc1c(cc(-c2cc(Cl)ccc2C(=O)N2Cc3ccccc3C[C@H]2CN2CCOCC2)n1C)C(=O)N(c1ccc(O)cc1)c1ccc2n(C)cnc2c1
BDBM50044940 NCC1(Cc2ccccc2-c2ccc(Cl)cc2)CCN(CC1)c1ccc(cc1)C(=O)NS(=O)(=O)c1ccc(N[C@H](CCN2CCOCC2)CSc2ccccc2)c(c1)S(=O)(=O)C(F)(F)F |r|
BDBM50044942 CCOC(=O)C1(Cc2ccccc2-c2ccc(Cl)cc2)CCN(CC1)c1ccc(cc1)C(=O)NS(=O)(=O)c1ccc(N[C@H](CCN2CCOCC2)CSc2ccccc2)c(c1)S(=O)(=O)C(F)(F)F |r|
BDBM50044944 OCC1(Cc2ccccc2-c2ccc(Cl)cc2)CCN(CC1)c1ccc(cc1)C(=O)NS(=O)(=O)c1ccc(N[C@H](CCN2CCOCC2)CSc2ccccc2)c(c1)S(=O)(=O)C(F)(F)F |r|
BDBM50044948 FC(F)(F)S(=O)(=O)c1cc(ccc1N[C@H](CCN1CCOCC1)CSc1ccccc1)S(=O)(=O)NC(=O)c1ccc(cc1)N1CCN(Cc2ccccc2-c2ncc(Cl)cn2)CC1 |r|
BDBM50044949 FC(F)(F)S(=O)(=O)c1cc(ccc1N[C@H](CCN1CCOCC1)CSc1ccccc1)S(=O)(=O)NC(=O)c1ccc(cc1)N1CCN(Cc2ccncc2-c2ccc(Cl)cc2)CC1 |r|
BDBM50044950 FC(F)(F)S(=O)(=O)c1cc(ccc1N[C@H](CCN1CCOCC1)CSc1ccccc1)S(=O)(=O)NC(=O)c1ccc(cc1)N1CCN(Cc2cccnc2-c2ccc(Cl)cc2)CC1 |r|
BDBM50044952 FC(F)(F)S(=O)(=O)c1cc(ccc1N[C@H](CCN1CCOCC1)CSc1ccccc1)S(=O)(=O)NC(=O)c1ccc(cc1)N1CCN(Cc2cn[nH]c2-c2ccc(Cl)cc2)CC1 |r|
BDBM60405 CN1CCN(C[C@@H]2Cc3ccccc3CN2C(=O)c2cc3OCOc3cc2-c2cc(C(=O)N(c3ccncc3)c3ccc(O)cc3)c(C)n2C)CC1
BDBM51910 Cc1c(cc(-c2cc3OCOc3cc2C(=O)N2Cc3ccccc3C[C@H]2CN2CCOCC2)n1C)C(=O)N(c1ccc(O)cc1)c1ccc2n(C)ccc2c1
BDBM50067364 [O-][N+](=O)c1ccc(cc1)S(=O)(=O)NC(=O)[C@H](Cc1ccc(Br)cc1)N1C(=S)S\C(=C/c2ccc(cc2)-c2ccc(Cl)cc2)C1=O |r|
BDBM50067354 Cc1ccc(cc1)S(=O)(=O)NC(=O)[C@H](Cc1ccccc1)N1C(=S)S\C(=C/c2ccc(cc2)-c2ccccc2)C1=O |r|
BDBM50067458 Clc1ccc(cc1)-c1ccc(\C=C2/SC(=S)N([C@@H](Cc3ccc(Br)cc3)C(=O)NS(=O)(=O)c3ccccc3)C2=O)cc1 |r|
BDBM50067460 [O-][N+](=O)c1ccc(cc1)-c1ccc(\C=C2/SC(=S)N([C@@H](Cc3ccc(Br)cc3)C(=O)NS(=O)(=O)c3ccccc3)C2=O)cc1 |r|
BDBM189506 COCCOCCS(=O)(=O)c1ccc(cc1Cl)S(=O)(=O)NC(=O)c1ccc(cc1Oc1cnc2[nH]ccc2c1)N1CCN(CC2=C(CC(C)(C)CC2)c2ccc(Cl)cc2)CC1 |t:48|
BDBM189507 COCCOCCS(=O)(=O)c1ccc(cc1[N+]([O-])=O)S(=O)(=O)NC(=O)c1ccc(cc1Oc1cnc2[nH]ccc2c1)N1CCN(CC2=C(CC(C)(C)CC2)c2ccc(Cl)cc2)CC1 |t:50|
BDBM189508 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(OC4CCC(CC4)N4CCOCC4)c(c3)[N+]([O-])=O)c(Oc3cnc4[nH]ccc4c3)c2)=C(C1)c1ccc(Cl)cc1 |c:63,(8.32,-14.13,;7.51,-12.83,;9.04,-12.88,;7.51,-11.29,;6.17,-10.52,;4.84,-11.29,;3.5,-10.52,;3.5,-8.98,;4.84,-8.21,;4.84,-6.67,;3.5,-5.9,;2.17,-6.67,;2.17,-8.21,;3.5,-4.36,;4.84,-3.59,;4.84,-2.05,;3.5,-1.28,;3.5,.26,;2.17,1.03,;4.84,1.03,;4.84,2.57,;6.38,2.57,;3.3,2.57,;4.84,4.11,;3.5,4.88,;3.5,6.42,;4.84,7.19,;4.84,8.73,;3.5,9.5,;2.17,8.73,;.84,9.5,;.84,11.04,;2.17,11.81,;3.5,11.04,;-.5,11.81,;-1.83,11.04,;-3.16,11.81,;-3.16,13.35,;-1.83,14.12,;-.5,13.35,;6.17,6.42,;6.17,4.88,;7.51,7.19,;7.51,8.73,;8.84,6.42,;2.17,-2.05,;.84,-1.28,;-.5,-2.05,;-.5,-3.59,;-1.83,-4.36,;-3.16,-3.59,;-4.63,-4.06,;-5.53,-2.82,;-4.63,-1.57,;-3.16,-2.05,;-1.83,-1.28,;2.17,-3.59,;4.84,-12.83,;6.17,-13.6,;3.5,-13.6,;3.5,-15.14,;2.17,-15.91,;.84,-15.14,;-.5,-15.91,;.84,-13.6,;2.17,-12.83,)|
BDBM177794 Cn1ccc2cc(ccc12)N(C(=O)c1cc(-c2cc3OCOc3cc2C(=O)N2Cc3ccccc3C[C@H]2CN2CCOCC2)n2CCCCc12)c1ccc(O)cc1
BDBM189542 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(OCC4COCCN4C4CCOCC4)c(c3)[N+]([O-])=O)c(Oc3cnc4[nH]ccc4c3)c2)=C(C1)c1ccc(Cl)cc1 |c:64|
BDBM189543 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(N[C@H]4CCCN(C4)C4CCOCC4)c(c3)[N+]([O-])=O)c(Oc3cnc4[nH]ccc4c3)c2)=C(C1)c1ccc(Cl)cc1 |c:63|
BDBM189544 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3cnc(NCC4CCOCC4)c(c3)C#N)c(Oc3cnc4[nH]ccc4c3)c2)=C(C1)c1ccc(Cl)cc1 |c:56|
BDBM189545 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(NN4CCS(=O)(=O)CC4)c(c3)[N+]([O-])=O)c(Oc3cnc4[nH]ccc4c3)c2)=C(C1)c1ccc(Cl)cc1 |c:58|
BDBM189546 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(NCC4(N)CCOCC4)c(c3)[N+]([O-])=O)c(Oc3cnc4[nH]ccc4c3)c2)=C(C1)c1ccc(Cl)cc1 |c:58|
BDBM50030750 OC(=O)c1nc(sc1CCOc1cccc(c1)-n1ncc2cncnc12)N1CCc2cccc(C(=O)Nc3nc4ccccc4s3)c2C1
BDBM50030755 CN(C)CC#Cc1ccc(OCCCc2sc(nc2C(O)=O)N2CCc3cccc(C(=O)Nc4nc5ccccc5s4)c3C2)c(Cl)c1
BDBM50030760 OC(=O)c1nc(sc1CCCCOc1ccc(cc1)-n1ncc2cncnc12)N1CCc2cccc(C(=O)Nc3nc4ccccc4s3)c2C1
BDBM189547 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3cnc(NC4CCC(CC4)N4CCOCC4)c(c3)C#N)c(Oc3cnc4[nH]ccc4c3)c2)=C(C1)c1ccc(Cl)cc1 |c:62,(12.12,-10.78,;11.3,-9.48,;12.84,-9.53,;11.3,-7.94,;9.97,-7.17,;8.64,-7.94,;7.3,-7.17,;7.3,-5.63,;8.64,-4.86,;8.64,-3.32,;7.3,-2.55,;5.97,-3.32,;5.97,-4.86,;7.3,-1.01,;8.64,-.24,;8.64,1.3,;7.3,2.07,;7.3,3.61,;8.64,4.38,;5.97,4.38,;5.97,5.92,;5.97,7.46,;7.51,5.92,;4.43,5.92,;3.66,4.59,;2.12,4.59,;1.35,5.92,;-.19,5.92,;-.96,7.26,;-2.5,7.26,;-3.27,8.59,;-2.5,9.93,;-.96,9.93,;-.19,8.59,;-3.27,11.26,;-4.81,11.26,;-5.58,12.59,;-4.81,13.93,;-3.27,13.93,;-2.5,12.59,;2.12,7.26,;3.66,7.26,;1.35,8.59,;.58,9.93,;5.97,1.3,;4.64,2.07,;3.3,1.3,;3.3,-.24,;1.97,-1.01,;.63,-.24,;-.83,-.71,;-1.74,.53,;-.83,1.78,;.63,1.3,;1.97,2.07,;5.97,-.24,;8.64,-9.48,;9.97,-10.25,;7.3,-10.25,;7.3,-11.79,;5.97,-12.56,;4.64,-11.79,;3.3,-12.56,;4.64,-10.25,;5.97,-9.48,)|
BDBM189548 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(NCC4CCOCC4)c(c3)C#N)c(Oc3cnc4[nH]ccc4c3)c2)=C(C1)c1ccc(Cl)cc1 |c:56|
BDBM189549 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(N[C@H]4CC[C@H](C4)N4CCOCC4)c(c3)[N+]([O-])=O)c(Oc3cnc4[nH]ccc4c3)c2)=C(C1)c1ccc(Cl)cc1 |c:62|
BDBM60816 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(NC4CCN(CC(F)(F)F)C4)c(c3)[N+]([O-])=O)c(Oc3cnc4[nH]ccc4c3)c2)=C(C1)c1ccc(Cl)cc1 |c:60|
BDBM189473 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(NCC4COCCO4)c(c3)[N+]([O-])=O)c(Oc3cnc4[nH]ccc4c3)c2)=C(C1)c1ccc(Cl)cc1 |c:57|
BDBM189509 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3cnc(NC4CCN(CC4)C4CCOCC4)c(Br)c3)c(Oc3cnc4[nH]ccc4c3)c2)=C(C1)c1ccc(Cl)cc1 |c:61|
BDBM189510 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(NCCC#N)c(c3)[N+]([O-])=O)c(Oc3cnc4[nH]ccc4c3)c2)=C(C1)c1ccc(Cl)cc1 |c:53|
BDBM189550 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(N[C@@H]4CC[C@@H](C4)N4CCOCC4)c(c3)[N+]([O-])=O)c(Oc3cnc4[nH]ccc4c3)c2)=C(C1)c1ccc(Cl)cc1 |c:62|
BDBM189551 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(NCC4CNCCO4)c(c3)[N+]([O-])=O)c(Oc3cnc4[nH]ccc4c3)c2)=C(C1)c1ccc(Cl)cc1 |c:57|
BDBM189552 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(NCC4CCOC4)c(c3)[N+]([O-])=O)c(Oc3cnc4[nH]ccc4c3)c2)=C(C1)c1ccc(Cl)cc1 |c:56|
BDBM178893 CC1(C)CC(=C(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3cnc(OCC4(F)CCOCC4)c(Cl)c3)c(Oc3cccc4[nH]ncc34)c2)CO1)c1ccc(Cl)cc1 |t:4|
BDBM178742 COC1CCC(CNc2ccc(cc2[N+]([O-])=O)S(=O)(=O)NC(=O)c2ccc(cc2Oc2ccc3[nH]ccc3c2)N2CCN(CC3=C(CC(C)(C)CC3)c3ccc(Cl)cc3)CC2)CC1 |t:48,(-10.81,3.18,;-10.04,1.85,;-8.5,1.85,;-7.73,.51,;-6.19,.51,;-5.42,1.85,;-3.88,1.85,;-3.11,3.18,;-1.57,3.18,;-.8,1.85,;.74,1.85,;1.51,3.18,;.74,4.52,;-.8,4.52,;-1.57,5.85,;-.8,7.18,;-3.11,5.85,;3.05,3.18,;3.05,4.72,;4.59,3.18,;3.05,1.64,;4.38,.87,;5.72,1.64,;4.38,-.67,;5.72,-1.44,;5.72,-2.98,;4.38,-3.75,;3.05,-2.98,;3.05,-1.44,;1.72,-.67,;.38,-1.44,;.38,-2.98,;-.95,-3.75,;-2.28,-2.98,;-3.75,-3.45,;-4.65,-2.21,;-3.75,-.96,;-2.28,-1.44,;-.95,-.67,;4.38,-5.29,;5.72,-6.06,;5.72,-7.6,;4.38,-8.37,;4.38,-9.91,;5.72,-10.68,;5.72,-12.22,;7.05,-12.99,;8.38,-12.22,;9.2,-13.52,;9.92,-12.27,;8.38,-10.68,;7.05,-9.91,;4.38,-12.99,;4.38,-14.53,;3.05,-15.3,;1.72,-14.53,;.38,-15.3,;1.72,-12.99,;3.05,-12.22,;3.05,-7.6,;3.05,-6.06,;-6.19,3.18,;-7.73,3.18,)|
BDBM189474 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(NCC(F)(F)F)c(c3)[N+]([O-])=O)c(Oc3cnc4[nH]ccc4c3)c2)=C(C1)c1ccc(Cl)cc1 |c:54|
BDBM189475 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(NCCC(F)(F)F)c(c3)[N+]([O-])=O)c(Oc3cnc4[nH]ccc4c3)c2)=C(C1)c1ccc(Cl)cc1 |c:55|
BDBM189476 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(OC[C@@H]4COCCO4)c(c3)[N+]([O-])=O)c(Oc3cnc4[nH]ccc4c3)c2)=C(C1)c1ccc(Cl)cc1 |c:57|
BDBM189512 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(NC4CCC(CC4)N(CC4CC4)CC4CC4)c(c3)[N+]([O-])=O)c(Oc3cnc4[nH]ccc4c3)c2)=C(C1)c1ccc(Cl)cc1 |c:67,(-4.12,-7.33,;-3.3,-6.03,;-4.84,-6.08,;-3.3,-4.49,;-1.97,-3.72,;-.63,-4.49,;.7,-3.72,;.7,-2.18,;2.03,-1.41,;2.03,.13,;.7,.9,;-.63,.13,;-.63,-1.41,;.7,2.44,;2.03,3.21,;2.03,4.75,;.7,5.52,;.7,7.06,;2.03,7.83,;-.63,7.83,;-.63,9.37,;-2.17,9.37,;.91,9.37,;-.63,10.91,;-1.97,11.68,;-1.97,13.22,;-.63,13.99,;-.63,15.53,;-1.97,16.3,;-3.3,15.53,;-4.63,16.3,;-4.63,17.84,;-3.3,18.61,;-1.97,17.84,;-5.97,18.61,;-7.3,17.84,;-8.64,18.61,;-10.18,18.61,;-9.41,19.95,;-5.97,20.15,;-4.63,20.92,;-3.86,22.26,;-3.09,20.92,;.7,13.22,;.7,11.68,;2.03,13.99,;3.37,13.22,;2.03,15.53,;-.63,4.75,;-1.97,5.52,;-3.3,4.75,;-3.3,3.21,;-4.63,2.44,;-5.97,3.21,;-7.43,2.74,;-8.34,3.98,;-7.43,5.23,;-5.97,4.75,;-4.63,5.52,;-.63,3.21,;-.63,-6.03,;-1.97,-6.8,;.7,-6.8,;2.03,-6.03,;3.37,-6.8,;3.37,-8.34,;4.7,-9.11,;2.03,-9.11,;.7,-8.34,)|
BDBM189553 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(NC4CCN(CC4)[C@H]4CCOC[C@H]4F)c(c3)[N+]([O-])=O)c(Oc3cnc4[nH]ccc4c3)c2)=C(C1)c1ccc(Cl)cc1 |c:64|
BDBM189554 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(NC4CN(C4)C4CCOCC4)c(c3)[N+]([O-])=O)c(Oc3cnc4[nH]ccc4c3)c2)=C(C1)c1ccc(Cl)cc1 |c:61|
BDBM189555 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(NC4CN(C4)C4CCOC4)c(c3)[N+]([O-])=O)c(Oc3cnc4[nH]ccc4c3)c2)=C(C1)c1ccc(Cl)cc1 |c:60|
BDBM60817 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(NC4C[C@H]5C[C@@H]4C=C5)c(c3)[N+]([O-])=O)c(Oc3cnc4[nH]ccc4c3)c2)=C(C1)c1ccc(Cl)cc1 |r,c:35,58|
BDBM60820 COCCOCCN1CCOC(CNc2ccc(cc2[N+]([O-])=O)S(=O)(=O)NC(=O)c2ccc(cc2Oc2cnc3[nH]ccc3c2)N2CCN(CC3=C(CC(C)(C)CC3)c3ccc(Cl)cc3)CC2)C1 |t:54|
BDBM60823 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(NCC4CCOCC4)c(CS(F)(F)(F)(F)F)c3)c(Oc3cnc4[nH]ccc4c3)c2)=C(C1)c1ccc(Cl)cc1 |c:61|
BDBM189478 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(OC[C@H]4COCCO4)c(c3)[N+]([O-])=O)c(Oc3cnc4[nH]ccc4c3)c2)=C(C1)c1ccc(Cl)cc1 |c:57|
BDBM189479 CC1(C)CC(=C(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(NCC4COCCO4)c(c3)[N+]([O-])=O)c(Oc3cnc4[nH]ccc4c3)c2)CO1)c1ccc(Cl)cc1 |t:4|
BDBM189513 CN1CCC(CNc2ccc(cc2[N+]([O-])=O)S(=O)(=O)NC(=O)c2ccc(cc2Oc2cnc3[nH]ccc3c2)N2CCN(CC3=C(CC(C)(C)CC3)c3ccc(Cl)cc3)CC2)CC1 |t:47|
BDBM189514 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(NCC4COCCN4)c(c3)[N+]([O-])=O)c(Oc3cnc4[nH]ccc4c3)c2)=C(C1)c1ccc(Cl)cc1 |c:57|
BDBM189515 CN1CCN(CC1)Nc1ccc(cc1[N+]([O-])=O)S(=O)(=O)NC(=O)c1ccc(cc1Oc1cnc2[nH]ccc2c1)N1CCN(CC2=C(CC(C)(C)OC2)c2ccc(Cl)cc2)CC1 |t:49|
BDBM60824 C[C@]1(O)C[C@H]2C[C@@H]1CC2CONc1ncc(cc1Cl)S(=O)(=O)NC(=O)c1ccc(cc1Oc1cnc2[nH]ccc2c1)N1CCN(CC2=C(CC(C)(C)CC2)c2ccc(Cl)cc2)CC1 |r,t:52|
BDBM60827 CC[C@]1(O)CCC(CNc2ccc(cc2[N+]([O-])=O)S(=O)(=O)NC(=O)c2ccc(cc2Oc2cnc3[nH]ccc3c2)N2CCN(CC3=C(CC(C)(C)CC3)c3ccc(Cl)cc3)CC2)CC1 |r,wU:2.2,wD:2.1,t:49,(-7.71,3.96,;-7.71,5.5,;-6.38,6.27,;-7.15,7.6,;-5.29,7.36,;-3.8,6.96,;-3.4,5.47,;-1.91,5.07,;-.83,6.16,;.71,6.16,;1.48,4.83,;3.02,4.83,;3.79,6.16,;3.02,7.49,;1.48,7.49,;.71,8.83,;1.48,10.16,;-.83,8.83,;5.33,6.16,;5.33,7.7,;6.87,6.16,;5.33,4.62,;6.67,3.85,;8,4.62,;6.67,2.31,;8,1.54,;8,,;6.67,-.77,;5.33,,;5.33,1.54,;4,2.31,;2.67,1.54,;2.67,,;1.33,-.77,;;-1.46,-.48,;-2.37,.77,;-1.46,2.02,;,1.54,;1.33,2.31,;6.67,-2.31,;8,-3.08,;8,-4.62,;6.67,-5.39,;6.67,-6.93,;8,-7.7,;8,-9.24,;9.34,-10.01,;10.67,-9.24,;11.44,-10.57,;12.16,-8.84,;10.67,-7.7,;9.34,-6.93,;6.67,-10.01,;6.67,-11.55,;5.33,-12.32,;4,-11.55,;2.67,-12.32,;4,-10.01,;5.33,-9.24,;5.33,-4.62,;5.33,-3.08,;-4.49,4.38,;-5.98,4.78,)|
BDBM189480 CC1(C)CC(=C(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(OCC4COCCO4)c(c3)[N+]([O-])=O)c(Oc3cnc4[nH]ccc4c3)c2)CO1)c1ccc(Cl)cc1 |t:4|
BDBM189516 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(OCC#CCN4CCOCC4)c(c3)[N+]([O-])=O)c(Oc3cnc4[nH]ccc4c3)c2)=C(C1)c1ccc(Cl)cc1 |c:60|
BDBM189517 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3cnc(OCC4CCOCC4)c(c3)C#C)c(Oc3cnc4[nH]ccc4c3)c2)=C(C1)c1ccc(Cl)cc1 |c:56|
BDBM189518 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc4nc[nH]c(=O)c4c3)c(Oc3cnc4[nH]ccc4c3)c2)=C(C1)c1ccc(Cl)cc1 |c:51|
BDBM189483 CC1(C)CC(=C(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3cnc(OCC4CCOCC4)c(c3)C#N)c(Oc3cnc4[nH]ccc4c3)c2)CO1)c1ccc(Cl)cc1 |t:4|
BDBM189484 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3cnc(OCC4CCOCC4)c(c3)C#N)c(Oc3cnc4[nH]ccc4c3)c2)=C(C1)c1ccc(Cl)cc1 |c:56|
BDBM189519 [O-][N+](=O)c1cc(ccc1NC1CCC(CC1)N1CCOCC1)S(=O)(=O)NC(=O)c1ccc(cc1Oc1cnc2[nH]ccc2c1)N1CCN(CC2=C(CCC3(CCCC3)C2)c2ccc(Cl)cc2)CC1 |t:55,(5.74,8.89,;4.2,8.89,;3.43,10.22,;3.43,7.55,;4.2,6.22,;3.43,4.89,;1.89,4.89,;1.12,6.22,;1.89,7.55,;1.12,8.89,;-.42,8.89,;-1.19,7.55,;-2.73,7.55,;-3.5,8.89,;-2.73,10.22,;-1.19,10.22,;-5.04,8.89,;-5.81,7.55,;-7.35,7.55,;-8.12,8.89,;-7.35,10.22,;-5.81,10.22,;4.2,3.55,;2.87,2.78,;5.53,4.32,;4.97,2.22,;4.2,.89,;2.66,.89,;4.97,-.45,;4.2,-1.78,;4.97,-3.12,;6.51,-3.12,;7.28,-1.78,;6.51,-.45,;7.28,.89,;8.82,.89,;9.59,2.22,;11.13,2.22,;11.9,.89,;13.41,.57,;13.57,-.97,;12.16,-1.59,;11.13,-.45,;9.59,-.45,;7.28,-4.45,;8.82,-4.45,;9.59,-5.78,;8.82,-7.12,;9.59,-8.45,;8.82,-9.78,;9.59,-11.12,;8.82,-12.45,;7.28,-12.45,;6.51,-11.12,;5.6,-12.36,;4.14,-11.89,;4.14,-10.35,;5.6,-9.87,;7.28,-9.78,;11.13,-11.12,;11.9,-9.78,;13.44,-9.78,;14.21,-11.12,;15.75,-11.12,;13.44,-12.45,;11.9,-12.45,;7.28,-7.12,;6.51,-5.78,)|
BDBM189520 COC1CCC(CNc2ccc(cc2[N+]([O-])=O)S(=O)(=O)NC(=O)c2ccc(cc2Oc2cnc3[nH]ccc3c2)N2CCN(CC3=C(CC(C)(C)OC3)c3ccc(Cl)cc3)CC2)CC1 |t:48,(-11.38,3.51,;-10.61,2.18,;-9.07,2.18,;-8.3,.84,;-6.76,.84,;-5.99,2.18,;-4.45,2.18,;-3.68,3.51,;-2.14,3.51,;-1.37,2.18,;.17,2.18,;.94,3.51,;.17,4.84,;-1.37,4.84,;-2.14,6.18,;-1.37,7.51,;-3.68,6.18,;2.48,3.51,;2.48,5.05,;4.02,3.51,;2.48,1.97,;3.81,1.2,;5.15,1.97,;3.81,-.34,;5.15,-1.11,;5.15,-2.65,;3.81,-3.42,;2.48,-2.65,;2.48,-1.11,;1.15,-.34,;-.19,-1.11,;-.19,-2.65,;-1.52,-3.42,;-2.85,-2.65,;-4.32,-3.12,;-5.22,-1.88,;-4.32,-.63,;-2.85,-1.11,;-1.52,-.34,;3.81,-4.96,;5.15,-5.73,;5.15,-7.27,;3.81,-8.04,;3.81,-9.58,;5.15,-10.35,;5.15,-11.89,;6.48,-12.66,;7.81,-11.89,;8.63,-13.19,;9.35,-11.94,;7.81,-10.35,;6.48,-9.58,;3.81,-12.66,;3.81,-14.2,;2.48,-14.97,;1.15,-14.2,;-.19,-14.97,;1.15,-12.66,;2.48,-11.89,;2.48,-7.27,;2.48,-5.73,;-6.76,3.51,;-8.3,3.51,)|
BDBM60815 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(NC4CCN(CC(F)(F)F)CC4)c(c3)[N+]([O-])=O)c(Oc3cnc4[nH]ccc4c3)c2)=C(C1)c1ccc(Cl)cc1 |c:61|
BDBM189485 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(OCC4(F)CCOCC4)c(c3)[N+]([O-])=O)c(Oc3cnc4[nH]ccc4c3)c2)=C(C1)c1ccc(Cl)cc1 |c:58|
BDBM189486 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(OCC4CCOCC4)c(c3)C(N)=O)c(Oc3cnc4[nH]ccc4c3)c2)=C(C1)c1ccc(Cl)cc1 |c:57|
BDBM189521 [O-][N+](=O)c1cc(ccc1OCC1(F)CCOCC1)S(=O)(=O)NC(=O)c1ccc(cc1Oc1cnc2[nH]ccc2c1)N1CCN(CC2=C(CCC3(CCCC3)C2)c2ccc(Cl)cc2)CC1 |t:50|
BDBM189522 COC1CCC(CNc2ccc(cc2[N+]([O-])=O)S(=O)(=O)NC(=O)c2ccc(cc2Oc2cnc3[nH]ccc3c2)N2CCN(CC3=C(CCC4(CCCC4)C3)c3ccc(Cl)cc3)CC2)CC1 |t:48,(-5.37,14.09,;-6.14,12.76,;-5.37,11.42,;-6.14,10.09,;-5.37,8.76,;-3.83,8.76,;-3.06,7.42,;-1.52,7.42,;-.75,6.09,;-1.52,4.75,;-.75,3.42,;.79,3.42,;1.56,4.75,;.79,6.09,;1.56,7.42,;3.1,7.42,;.79,8.76,;1.56,2.09,;.23,1.32,;2.89,2.86,;2.33,.75,;1.56,-.58,;.02,-.58,;2.33,-1.91,;1.56,-3.25,;2.33,-4.58,;3.87,-4.58,;4.64,-3.25,;3.87,-1.91,;4.64,-.58,;6.18,-.58,;6.95,.75,;8.49,.75,;9.26,-.58,;10.77,-.9,;10.93,-2.43,;9.52,-3.06,;8.49,-1.91,;6.95,-1.91,;4.64,-5.91,;6.18,-5.91,;6.95,-7.25,;6.18,-8.58,;6.95,-9.92,;6.18,-11.25,;6.95,-12.58,;6.18,-13.92,;4.64,-13.92,;3.87,-12.58,;2.97,-13.83,;1.5,-13.35,;1.5,-11.81,;2.97,-11.34,;4.64,-11.25,;8.49,-12.58,;9.26,-11.25,;10.8,-11.25,;11.57,-12.58,;13.11,-12.58,;10.8,-13.92,;9.26,-13.92,;4.64,-8.58,;3.87,-7.25,;-3.06,10.09,;-3.83,11.42,)|
BDBM189523 CC1(C)CCC(=C(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(NCC4CCOCC4)c(c3)[N+]([O-])=O)c(Oc3cnc4[nH]ccc4c3)c2)C1)c1ccc(Cl)cc1 |t:5|
BDBM189455 [O-][N+](=O)c1cc(ccc1NCC1CCOCC1)S(=O)(=O)NC(=O)c1ccc(cc1Oc1cnc2[nH]ccc2c1)N1CCN(Cc2ccccc2-c2ccc(Cl)cc2)CC1
BDBM189456 [O-][N+](=O)c1cc(ccc1NCCCN1CCOCC1)S(=O)(=O)NC(=O)c1ccc(cc1Oc1cnc2[nH]ccc2c1)N1CCN(Cc2ccccc2-c2ccc(Cl)cc2)CC1
BDBM189457 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(NC4CCN(CC4)C4CCOCC4)c(c3)[N+]([O-])=O)c(Oc3cnc4[nH]ccc4c3)c2)=C(C1)c1ccc(Cl)cc1 |c:63|
BDBM189488 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3cnc(OCC4CCOCC4)c(Cl)c3)c(Oc3cnc4[nH]ccc4c3)c2)=C(C1)c1ccc(Cl)cc1 |c:55|
BDBM189489 CC1(C)CC(=C(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3cnc(OCC4CCOCC4)c(Cl)c3)c(Oc3cnc4[nH]ccc4c3)c2)CO1)c1ccc(Cl)cc1 |t:4|
BDBM189490 CC1(C)CC(=C(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(NCC4CCOCC4)c(c3)C(F)(F)F)c(Oc3cnc4[nH]ccc4c3)c2)CO1)c1ccc(Cl)cc1 |t:4|
BDBM189524 CC1(C)CCC(=C(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3cnc(OCC4CCOCC4)c(c3)C#N)c(Oc3cnc4[nH]ccc4c3)c2)C1)c1ccc(Cl)cc1 |t:5|
BDBM189525 CC(C)(C)OC(=O)N1CCOCC1COc1ccc(cc1[N+]([O-])=O)S(=O)(=O)NC(=O)c1ccc(cc1Oc1cnc2[nH]ccc2c1)N1CCN(CC2=C(CC(C)(C)CC2)c2ccc(Cl)cc2)CC1 |t:56|
BDBM189526 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(OCC4COCCN4)c(c3)[N+]([O-])=O)c(Oc3cnc4[nH]ccc4c3)c2)=C(C1)c1ccc(Cl)cc1 |c:57|
BDBM50078015 CCOc1ccccc1N\N=C1/C(C)=NN(C1=O)c1nc(cs1)-c1ccccc1 |c:14|
BDBM50078016 CC1=NN(C(=O)\C1=C\C(c1ccccc1)c1ccccc1)c1nc(cs1)-c1ccccc1 |t:1|
BDBM50078017 CC1=NN(C(=O)\C1=C\c1ccc(cc1)-c1ccccc1)c1nc(cs1)-c1ccccc1 |t:1|
BDBM50078018 CC1=NN(C(=O)\C1=C\c1ccc2ccccc2c1)c1nc(cs1)-c1ccccc1 |t:1|
BDBM189458 CN1CCC(CC1)Nc1ccc(cc1[N+]([O-])=O)S(=O)(=O)NC(=O)c1ccc(cc1Oc1cnc2[nH]ccc2c1)N1CCN(CC2=C(CC(C)(C)CC2)c2ccc(Cl)cc2)CC1 |t:49|
BDBM189460 CN1CCN(CC1)Nc1ccc(cc1[N+]([O-])=O)S(=O)(=O)NC(=O)c1ccc(cc1Oc1cnc2[nH]ccc2c1)N1CCN(CC2=C(CC(C)(C)CC2)c2ccc(Cl)cc2)CC1 |t:49|
BDBM189491 CC1(C)CC(=C(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(NCC4CCOCC4)c(c3)S(=O)(=O)C(F)(F)F)c(Oc3cnc4[nH]ccc4c3)c2)CO1)c1ccc(Cl)cc1 |t:4|
BDBM189492 CC1(C)CC(=C(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(NC4CCC(CC4)N4CCOCC4)c(c3)S(=O)(=O)C(F)(F)F)c(Oc3cnc4[nH]ccc4c3)c2)CO1)c1ccc(Cl)cc1 |t:4,(8.65,-14.57,;7.84,-13.26,;9.38,-13.32,;6.5,-14.03,;5.17,-13.26,;5.17,-11.72,;3.84,-10.95,;3.84,-9.41,;5.17,-8.64,;5.17,-7.1,;3.84,-6.33,;2.5,-7.1,;2.5,-8.64,;3.84,-4.79,;5.17,-4.02,;5.17,-2.48,;3.84,-1.71,;3.84,-.17,;2.5,.6,;5.17,.6,;5.17,2.14,;6.71,2.14,;3.63,2.14,;5.17,3.68,;3.84,4.45,;3.84,5.99,;5.17,6.76,;5.17,8.3,;3.84,9.07,;2.5,8.3,;1.17,9.07,;1.17,10.61,;2.5,11.38,;3.84,10.61,;-.16,11.38,;-1.5,10.61,;-2.83,11.38,;-2.83,12.92,;-1.5,13.69,;-.16,12.92,;6.5,5.99,;6.5,4.45,;7.84,6.76,;7.07,8.09,;9.17,7.53,;8.61,5.42,;9.94,6.19,;7.27,4.65,;9.38,4.09,;2.5,-2.48,;1.17,-1.71,;-.16,-2.48,;-.16,-4.02,;-1.5,-4.79,;-2.83,-4.02,;-4.3,-4.5,;-5.2,-3.25,;-4.3,-2.01,;-2.83,-2.48,;-1.5,-1.71,;2.5,-4.02,;6.5,-10.95,;7.84,-11.72,;3.84,-14.03,;3.84,-15.57,;2.5,-16.34,;1.17,-15.57,;-.16,-16.34,;1.17,-14.03,;2.5,-13.26,)|
BDBM189493 CN1CCC(CC1)Nc1ccc(cc1S(=O)(=O)C(F)(F)F)S(=O)(=O)NC(=O)c1ccc(cc1Oc1cnc2[nH]ccc2c1)N1CCN(CC2=C(CC(C)(C)OC2)c2ccc(Cl)cc2)CC1 |t:53|
BDBM189527 [O-][N+](=O)c1cc(ccc1NCC1CCOCC1)S(=O)(=O)NC(=O)c1ccc(cc1Oc1cnc2[nH]ccc2c1)N1CCN(CC2=C(CCC3(CCCC3)C2)c2ccc(Cl)cc2)CC1 |t:49|
BDBM189528 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(NC4CCN(CC4)S(C)(=O)=O)c(c3)[N+]([O-])=O)c(Oc3cnc4[nH]ccc4c3)c2)=C(C1)c1ccc(Cl)cc1 |c:60|
BDBM189529 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(Cl)c(c3)[N+]([O-])=O)c(Oc3cnc4[nH]ccc4c3)c2)=C(C1)c1ccc(Cl)cc1 |c:49|
BDBM50078019 CC1=NN(C(=O)\C1=C\c1ncc[nH]1)c1nc(cs1)-c1ccccc1 |t:1|
BDBM50078020 CCOc1ccccc1CC(=O)C1C(C)=NN(C1=O)c1nc(cs1)-c1ccccc1 |c:15|
BDBM50078022 CCOc1ccccc1N\N=C1\C(C)=NN(C1=O)c1cc(O)cc(c1)-c1ccc(cc1)N(C)C |c:14|
BDBM50078024 CCOc1ccccc1N\N=C1\C(C)=NN(C1=O)c1cc(O)cc(c1)-c1ccncc1 |c:14|
BDBM50078025 CCOc1ccccc1N\N=C1\C(C)=NN(C1=O)c1cc(O)cc(c1)-c1cccs1 |c:14|
BDBM50078027 CCOc1ccccc1N\N=C1\C(C)=NN(C1=O)c1cc(O)cc(c1)-c1ccc(cc1)C(C)C |c:14|
BDBM50078028 CCOc1ccccc1N\N=C1\C(C)=NN(C1=O)c1cccc(c1)-c1ccc(cc1)N(C)C |c:14|
BDBM189461 CN1CCC(CC1)Nc1ccc(cc1[N+]([O-])=O)S(=O)(=O)NC(=O)c1ccc(cc1Oc1cccc2[nH]c3ccccc3c12)N1CCN(CC2=C(CC(C)(C)CC2)c2ccc(Cl)cc2)CC1 |t:54|
BDBM189462 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(NCCCN4CCCC4)c(c3)[N+]([O-])=O)c(Oc3cccc4[nH]c5ccccc5c34)c2)=C(C1)c1ccc(Cl)cc1 |c:63|
BDBM189494 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3cnc(OCC4CCOCC4)c(c3)C(N)=O)c(Oc3cnc4[nH]ccc4c3)c2)=C(C1)c1ccc(Cl)cc1 |c:57|
BDBM189495 CN1CCC(COc2ncc(cc2Br)S(=O)(=O)NC(=O)c2ccc(cc2Oc2cnc3[nH]ccc3c2)N2CCN(CC3=C(CC(C)(C)CC3)c3ccc(Cl)cc3)CC2)CC1 |t:45|
BDBM189496 CN1CCC(COc2ccc(cc2[N+]([O-])=O)S(=O)(=O)NC(=O)c2ccc(cc2Oc2cnc3[nH]ccc3c2)N2CCN(CC3=C(CC(C)(C)CC3)c3ccc(Cl)cc3)CC2)CC1 |t:47|
BDBM189530 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3cnc(OC4CCN(CC4)C4CCOCC4)c(c3)C#N)c(Oc3cnc4[nH]ccc4c3)c2)=C(C1)c1ccc(Cl)cc1 |c:62|
BDBM189531 CC(C)c1cc(cnc1OCC1CCOCC1)S(=O)(=O)NC(=O)c1ccc(cc1Oc1cnc2[nH]ccc2c1)N1CCN(CC2=C(CC(C)(C)CC2)c2ccc(Cl)cc2)CC1 |t:49|
BDBM189532 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3cc(F)c(NCC4CCOCC4)c(Cl)c3)c(Oc3cnc4[nH]ccc4c3)c2)=C(C1)c1ccc(Cl)cc1 |c:56|
BDBM50078029 CN(C)c1ccc(cc1)-c1cc(O)cc(c1)N1N=C(C)\C(=N\Nc2ccc3ccccc3c2)C1=O |t:19|
BDBM50078030 CC1=NN(C(=O)\C1=C\c1ccccc1)c1nc(cs1)-c1ccccc1 |t:1|
BDBM189464 COCCNc1ccc(cc1[N+]([O-])=O)S(=O)(=O)NC(=O)c1ccc(cc1Oc1cnc2[nH]ccc2c1)N1CCN(CC2=C(CC(C)(C)CC2)c2ccc(Cl)cc2)CC1 |t:45|
BDBM189465 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(NC[C@@H]4CCCOC4)c(c3)[N+]([O-])=O)c(Oc3cnc4[nH]ccc4c3)c2)=C(C1)c1ccc(Cl)cc1 |c:57|
BDBM189466 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(OCC4COCCO4)c(c3)[N+]([O-])=O)c(Oc3cnc4[nH]ccc4c3)c2)=C(C1)c1ccc(Cl)cc1 |c:57|
BDBM189497 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3cnc(OCC4COCCO4)c(c3)C#N)c(Oc3cnc4[nH]ccc4c3)c2)=C(C1)c1ccc(Cl)cc1 |c:56|
BDBM189498 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3cnc(OCC4COCCO4)c(Br)c3)c(Oc3cnc4[nH]ccc4c3)c2)=C(C1)c1ccc(Cl)cc1 |c:55|
BDBM189499 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(OCC4CCOC(C)(C)C4)c(c3)[N+]([O-])=O)c(Oc3cnc4[nH]ccc4c3)c2)=C(C1)c1ccc(Cl)cc1 |c:59|
BDBM189533 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(NC4CCN(CC4)C(CF)CF)c(c3)[N+]([O-])=O)c(Oc3cnc4[nH]ccc4c3)c2)=C(C1)c1ccc(Cl)cc1 |c:61|
BDBM189534 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3cnc(OCC4(F)CCOCC4)c(Cl)c3)c(Oc3cnc4[nH]ccc4c3)c2)=C(C1)c1ccc(Cl)cc1 |c:56|
BDBM189535 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(NC4CCN(CC(F)F)CC4)c(c3)[N+]([O-])=O)c(Oc3cnc4[nH]ccc4c3)c2)=C(C1)c1ccc(Cl)cc1 |c:60|
BDBM50078160 Cc1nn(C)c(COc2ccc(cc2)N2CCN(CC2)S(C)(=O)=O)c1-c1cccc2c(CCCOc3cccc4ccccc34)c(C(O)=O)n(CCN3CCOCC3)c12 |(-2.81,-12.36,;-3.79,-13.11,;-3.77,-14.65,;-5.22,-15.15,;-5.58,-16.33,;-6.15,-13.92,;-7.69,-13.93,;-8.44,-15.28,;-9.98,-15.29,;-10.74,-16.63,;-12.28,-16.64,;-13.06,-15.32,;-12.3,-13.98,;-10.76,-13.96,;-14.6,-15.33,;-15.37,-16.67,;-16.91,-16.68,;-17.68,-15.35,;-16.92,-14.01,;-15.38,-14,;-19.23,-15.36,;-19.85,-14.3,;-19.83,-16.43,;-20.46,-15.37,;-5.26,-12.68,;-5.74,-11.22,;-7.27,-10.9,;-7.75,-9.44,;-6.72,-8.27,;-5.21,-8.6,;-3.97,-7.71,;-3.98,-6.17,;-2.65,-5.4,;-2.66,-3.85,;-1.33,-3.08,;-1.33,-1.54,;-2.68,-.77,;-2.68,.77,;-1.33,1.54,;,.77,;1.33,1.54,;2.66,.77,;2.66,-.77,;1.33,-1.54,;,-.77,;-2.74,-8.57,;-1.29,-8.05,;-.35,-8.85,;-1.06,-6.84,;-3.2,-10.04,;-2.28,-11.27,;-.75,-11.09,;.17,-12.33,;1.7,-12.15,;2.62,-13.39,;2.01,-14.8,;.48,-14.98,;-.44,-13.74,;-4.73,-10.05,)|
BDBM50078166 OC(=O)c1[nH]c2ccccc2c1CCCCC1CCCCC1
BDBM60828 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(NCC4CCOCC4)c(c3)[N+]([O-])=O)c(Oc3cnc4[nH]ccc4c3)c2)=C(C1)c1ccc(Cl)cc1 |c:57|
BDBM189467 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(NC[C@H]4CCCOC4)c(c3)[N+]([O-])=O)c(Oc3cnc4[nH]ccc4c3)c2)=C(C1)c1ccc(Cl)cc1 |c:57|
BDBM189468 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc4ccccc4c3)c(Oc3cnc4[nH]ccc4c3)c2)=C(C1)c1ccc(Cl)cc1 |c:50|
BDBM189469 CC1(C)CC(=C(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(NCC4CCOCC4)c(c3)[N+]([O-])=O)c(Oc3cnc4[nH]ccc4c3)c2)CO1)c1ccc(Cl)cc1 |t:4|
BDBM189500 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3cc(Cl)c(NCC4CCOCC4)c(c3)C#N)c(Oc3cnc4[nH]ccc4c3)c2)=C(C1)c1ccc(Cl)cc1 |c:57|
BDBM189501 CC(=O)N1CCC(CC1)Nc1ccc(cc1[N+]([O-])=O)S(=O)(=O)NC(=O)c1ccc(cc1Oc1cnc2[nH]ccc2c1)N1CCN(CC2=C(CC(C)(C)CC2)c2ccc(Cl)cc2)CC1 |t:51|
BDBM189502 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3cc(F)c(NCC4CCOCC4)cc3Cl)c(Oc3cnc4[nH]ccc4c3)c2)=C(C1)c1ccc(Cl)cc1 |c:56|
BDBM189536 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(NC4CCN(CC4)C4CC4)c(c3)[N+]([O-])=O)c(Oc3cnc4[nH]ccc4c3)c2)=C(C1)c1ccc(Cl)cc1 |c:60|
BDBM189537 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(NCC4(CCCCC4)N4CCOCC4)c(c3)[N+]([O-])=O)c(Oc3cnc4[nH]ccc4c3)c2)=C(C1)c1ccc(Cl)cc1 |c:64|
BDBM189538 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(NC4CCC(CC4)N(C4CC4)C4CC4)c(c3)[N+]([O-])=O)c(Oc3cnc4[nH]ccc4c3)c2)=C(C1)c1ccc(Cl)cc1 |c:65,(4.56,-9.33,;3.74,-8.02,;5.28,-8.07,;3.74,-6.48,;2.41,-5.71,;1.07,-6.48,;-.26,-5.71,;-.26,-4.17,;1.07,-3.4,;1.07,-1.86,;-.26,-1.09,;-1.59,-1.86,;-1.59,-3.4,;-.26,.45,;1.07,1.22,;1.07,2.76,;-.26,3.53,;-.26,5.07,;-1.59,5.84,;1.07,5.84,;1.07,7.38,;2.61,7.38,;-.47,7.38,;1.07,8.92,;-.26,9.69,;-.26,11.23,;1.07,12,;1.07,13.54,;-.26,14.31,;-1.59,13.54,;-2.93,14.31,;-2.93,15.85,;-1.59,16.62,;-.26,15.85,;-4.26,16.62,;-4.26,18.16,;-5.03,19.49,;-3.49,19.49,;-5.6,15.85,;-6.37,14.52,;-7.14,15.85,;2.41,11.23,;2.41,9.69,;3.74,12,;3.74,13.54,;5.07,11.23,;-1.59,2.76,;-2.93,3.53,;-4.26,2.76,;-4.26,1.22,;-5.6,.45,;-6.93,1.22,;-8.39,.74,;-9.3,1.99,;-8.39,3.24,;-6.93,2.76,;-5.6,3.53,;-1.59,1.22,;1.07,-8.02,;2.41,-8.79,;-.26,-8.79,;-.26,-10.33,;-1.59,-11.1,;-2.93,-10.33,;-4.26,-11.1,;-2.93,-8.79,;-1.59,-8.02,)|
BDBM189470 COCCNc1ccc(cc1S(=O)(=O)C(F)(F)F)S(=O)(=O)NC(=O)c1ccc(cc1Oc1cnc2[nH]ccc2c1)N1CCN(CC2=C(CC(C)(C)CC2)c2ccc(Cl)cc2)CC1 |t:49|
BDBM189471 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(NCC4CCOCC4)c(c3)S(=O)(=O)C(F)(F)F)c(Oc3cnc4[nH]ccc4c3)c2)=C(C1)c1ccc(Cl)cc1 |c:61|
BDBM189472 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(OCC4CCOCC4)c(c3)[N+]([O-])=O)c(Oc3cnc4[nH]ccc4c3)c2)=C(C1)c1ccc(Cl)cc1 |c:57|
BDBM189503 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(NCCCN4CCOCC4)c(c3)[N+]([O-])=O)c(Oc3cnc4[nH]ccc4c3)c2)=C(C1)c1ccc(Cl)cc1 |c:59|
BDBM189504 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3cnc(OCC4(F)CCOCC4)c(c3)C#N)c(Oc3cnc4[nH]ccc4c3)c2)=C(C1)c1ccc(Cl)cc1 |c:57|
BDBM189505 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3cnc(OCCN4CCOCC4)c(c3)C#N)c(Oc3cnc4[nH]ccc4c3)c2)=C(C1)c1ccc(Cl)cc1 |c:57|
BDBM189539 CC1(C)CCCC(=C1CN1CCN(CC1)c1ccc(C(=O)NS(=O)(=O)c2ccc(NCC3CCOCC3)c(c2)[N+]([O-])=O)c(Oc2cnc3[nH]ccc3c2)c1)c1ccc(Cl)cc1 |c:6|
BDBM189540 CCN1CCOCC1COc1ncc(cc1Br)S(=O)(=O)NC(=O)c1ccc(cc1Oc1cnc2[nH]ccc2c1)N1CCN(CC2=C(CC(C)(C)CC2)c2ccc(Cl)cc2)CC1 |t:49|
BDBM189541 CCN1CCOCC1COc1ccc(cc1[N+]([O-])=O)S(=O)(=O)NC(=O)c1ccc(cc1Oc1cnc2[nH]ccc2c1)N1CCN(CC2=C(CC(C)(C)CC2)c2ccc(Cl)cc2)CC1 |t:51|
BDBM189788 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(NC[C@H]4CN(CCO4)C4COC4)c(c3)[N+]([O-])=O)c(Oc3cnc4[nH]ccc4c3)c2)=C(C1)c1ccc(Cl)cc1 |c:62|
BDBM189789 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(OCC4CCC(C)(O)CC4)c(Cl)c3)c(Oc3cnc4[nH]ccc4c3)c2)=C(C1)c1ccc(Cl)cc1 |c:57,(11.53,-12.3,;10.71,-10.99,;12.25,-11.04,;10.71,-9.45,;9.38,-8.68,;8.04,-9.45,;6.71,-8.68,;6.71,-7.14,;8.04,-6.37,;8.04,-4.83,;6.71,-4.06,;5.38,-4.83,;5.38,-6.37,;6.71,-2.52,;8.04,-1.75,;8.04,-.21,;6.71,.56,;6.71,2.1,;8.04,2.87,;5.38,2.87,;5.38,4.41,;6.92,4.41,;5.38,5.95,;3.84,4.41,;3.07,5.74,;1.53,5.74,;.76,4.41,;-.78,4.41,;-1.55,3.08,;-3.09,3.08,;-3.86,1.74,;-5.4,1.74,;-6.17,3.08,;-7.53,2.35,;-7.53,3.8,;-5.4,4.41,;-3.86,4.41,;1.53,3.08,;.76,1.74,;3.07,3.08,;5.38,-.21,;4.04,.56,;2.71,-.21,;2.71,-1.75,;1.37,-2.52,;.04,-1.75,;-1.42,-2.23,;-2.33,-.98,;-1.42,.27,;.04,-.21,;1.37,.56,;5.38,-1.75,;8.04,-10.99,;9.38,-11.76,;6.71,-11.76,;6.71,-13.3,;5.38,-14.07,;4.04,-13.3,;2.71,-14.07,;4.04,-11.76,;5.38,-10.99,)|
BDBM189803 COC1(C)CCC(=C(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(NCC4CCC(C)(O)CC4)c(c3)[N+]([O-])=O)c(Oc3cnc4[nH]ccc4c3)c2)C1)c1ccc(Cl)cc1 |t:6,(7.24,-3.72,;7.96,-5.08,;7.15,-6.39,;8.68,-6.33,;7.15,-7.93,;5.81,-8.7,;4.48,-7.93,;4.48,-6.39,;3.14,-5.62,;3.14,-4.08,;4.48,-3.31,;4.48,-1.77,;3.14,-1,;1.81,-1.77,;1.81,-3.31,;3.14,.54,;4.48,1.31,;4.48,2.85,;3.14,3.62,;3.14,5.16,;4.48,5.93,;1.81,5.93,;1.81,7.47,;1.81,9.01,;3.35,7.47,;.27,7.47,;-.5,6.14,;-2.04,6.14,;-2.81,7.47,;-4.35,7.47,;-5.12,6.14,;-6.66,6.14,;-7.43,4.81,;-8.97,4.81,;-9.74,6.14,;-11.1,5.42,;-11.1,6.86,;-8.97,7.47,;-7.43,7.47,;-2.04,8.81,;-.5,8.81,;-2.81,10.14,;-2.04,11.48,;-4.35,10.14,;1.81,2.85,;.48,3.62,;-.86,2.85,;-.86,1.31,;-2.19,.54,;-3.52,1.31,;-4.99,.84,;-5.89,2.08,;-4.99,3.33,;-3.52,2.85,;-2.19,3.62,;1.81,1.31,;5.81,-5.62,;3.14,-8.7,;3.14,-10.24,;1.81,-11.01,;.48,-10.24,;-.86,-11.01,;.48,-8.7,;1.81,-7.93,)|
BDBM189675 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3cnc(OC[C@@H]4CN(CC#N)CCO4)c(Cl)c3)c(Oc3cnc4[nH]ccc4c3)c2)=C(C1)c1ccc(Cl)cc1 |c:58|
BDBM189676 CN(C)CC(=O)N1CCO[C@H](COc2ncc(cc2Cl)S(=O)(=O)NC(=O)c2ccc(cc2Oc2cnc3[nH]ccc3c2)N2CCN(CC3=C(CC(C)(C)CC3)c3ccc(Cl)cc3)CC2)C1 |t:51|
BDBM189677 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3cnc(OC[C@H]4CN(CC#N)CCO4)c(Cl)c3)c(Oc3cnc4[nH]ccc4c3)c2)=C(C1)c1ccc(Cl)cc1 |c:58|
BDBM189719 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3cnc(OCCC4CCCO4)c(Cl)c3)c(Oc3cnc4[nH]ccc4c3)c2)=C(C1)c1ccc(Cl)cc1 |c:55|
BDBM189720 CC1CN(CCN1CC1=C(CC(C)(C)CC1)c1ccc(Cl)cc1)c1ccc(C(=O)NS(=O)(=O)c2ccc(NCC3CCOCC3)c(c2)[N+]([O-])=O)c(Oc2cnc3[nH]ccc3c2)c1 |t:9|
BDBM189721 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(NCCCNC4CC4)c(c3)[N+]([O-])=O)c(Oc3cnc4[nH]ccc4c3)c2)=C(C1)c1ccc(Cl)cc1 |c:57|
BDBM177836 Cn1ccc2cc(ccc12)N(C(=O)c1cc(-c2cc(Cl)ccc2C(=O)N2Cc3ccccc3C[C@H]2CN2CCOCC2)n2CCCCc12)c1ccc(O)c(F)c1
BDBM177837 Cn1ccc2cc(ccc12)N(C(=O)c1cc(-c2ccccc2C(=O)N2Cc3ccccc3C[C@H]2CN2CCOCC2)n2ccccc12)c1ccc(O)cc1
BDBM177839 Oc1ccc(cc1)N(C(=O)c1cc(-c2cc3OCOc3cc2C(=O)N2Cc3ccccc3C[C@H]2CN2CCOCC2)n2ccccc12)c1ccccc1
BDBM177900 Oc1ccc(cc1)N(C(=O)c1cc(-c2cc(Cl)ccc2C(=O)N2Cc3ccccc3C[C@H]2CN2CCOCC2)n2CCCCc12)c1cccc(Cl)c1
BDBM177901 Oc1ccc(cc1)N(C(=O)c1cc(-c2cc(Cl)ccc2C(=O)N2Cc3ccccc3C[C@H]2CN2CCOCC2)n2CCCCc12)c1ccccc1C#N
BDBM177902 Cn1cc(cn1)N(C(=O)c1cc(-c2cc(Cl)ccc2C(=O)N2Cc3ccccc3C[C@H]2CN2CCOCC2)n2CCCCc12)c1ccc(O)cc1
BDBM189585 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(NCC4CCCN(C4)S(C)(=O)=O)c(c3)[N+]([O-])=O)c(Oc3cnc4[nH]ccc4c3)c2)=C(C1)c1ccc(Cl)cc1 |c:61|
BDBM189586 CC(=O)N1CCCC(CNc2ccc(cc2[N+]([O-])=O)S(=O)(=O)NC(=O)c2ccc(cc2Oc2cnc3[nH]ccc3c2)N2CCN(CC3=C(CC(C)(C)CC3)c3ccc(Cl)cc3)CC2)C1 |t:50|
BDBM189587 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(N[C@@H]4CCN(C4)S(C)(=O)=O)c(c3)[N+]([O-])=O)c(Oc3cnc4[nH]ccc4c3)c2)=C(C1)c1ccc(Cl)cc1 |c:59|
BDBM177789 Cc1ccc(cc1F)N(C(=O)c1cc(-c2cc3OCOc3cc2C(=O)N2Cc3ccccc3C[C@H]2CN2CCOCC2)n2CCCCc12)c1ccc(O)cc1
BDBM177831 Cn1ncc2cc(ccc12)N(C(=O)c1cc(-c2cc3OCOc3cc2C(=O)N2Cc3ccccc3C[C@H]2CN2CCOCC2)n2CCCCc12)c1ccc(O)cc1
BDBM189644 COC1CCC(COc2ncc(cc2Cl)S(=O)(=O)NC(=O)c2ccc(cc2Oc2cnc3[nH]ccc3c2)N2CCN(CC3=C(CC(C)(C)CC3)c3ccc(Cl)cc3)CC2)CC1 |t:46,(14.3,.47,;12.96,-.3,;11.63,.47,;11.63,2.01,;10.3,2.78,;8.96,2.01,;7.63,2.78,;6.3,2.01,;4.96,2.78,;3.63,2.01,;2.29,2.78,;2.29,4.32,;3.63,5.09,;4.96,4.32,;6.3,5.09,;.96,5.09,;1.73,6.43,;.19,3.76,;-.37,5.86,;-1.71,5.09,;-3.04,5.86,;-1.71,3.55,;-.37,2.78,;-.37,1.24,;-1.71,.47,;-3.04,1.24,;-3.04,2.78,;-4.37,3.55,;-5.71,2.78,;-5.71,1.24,;-7.04,.47,;-8.37,1.24,;-9.84,.77,;-10.74,2.01,;-9.84,3.26,;-8.37,2.78,;-7.04,3.55,;-1.71,-1.07,;-.37,-1.84,;-.37,-3.38,;-1.71,-4.15,;-1.71,-5.69,;-3.04,-6.46,;-3.04,-8,;-4.37,-8.77,;-5.71,-8,;-6.52,-9.3,;-7.25,-8.05,;-5.71,-6.46,;-4.37,-5.69,;-1.71,-8.77,;-.37,-8,;.96,-8.77,;.96,-10.31,;2.29,-11.08,;-.37,-11.08,;-1.71,-10.31,;-3.04,-3.38,;-3.04,-1.84,;8.96,.47,;10.3,-.3,)|
BDBM189638 CN1CC(CC1=O)Nc1ccc(cc1[N+]([O-])=O)S(=O)(=O)NC(=O)c1ccc(cc1Oc1cnc2[nH]ccc2c1)N1CCN(CC2=C(CC(C)(C)CC2)c2ccc(Cl)cc2)CC1 |t:49|
BDBM189747 COC(=O)N1CCOC(CNc2ccc(cc2[N+]([O-])=O)S(=O)(=O)NC(=O)c2ccc(cc2Oc2cnc3[nH]ccc3c2)N2CCN(CC3=C(CC(C)(C)CC3)c3ccc(Cl)cc3)CC2)C1 |t:51|
BDBM189748 CCN(C)C(=O)N1CCOC(CNc2ccc(cc2[N+]([O-])=O)S(=O)(=O)NC(=O)c2ccc(cc2Oc2cnc3[nH]ccc3c2)N2CCN(CC3=C(CC(C)(C)CC3)c3ccc(Cl)cc3)CC2)C1 |t:53|
BDBM189749 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(NCC4CN(CCO4)S(C)(=O)=O)c(c3)[N+]([O-])=O)c(Oc3cnc4[nH]ccc4c3)c2)=C(C1)c1ccc(Cl)cc1 |c:61|
BDBM189790 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(OCC4(F)CCC(CC4)N(CCC#N)C4CC4)c(c3)[N+]([O-])=O)c(Oc3cnc4[nH]ccc4c3)c2)=C(C1)c1ccc(Cl)cc1 |c:67,(11.49,-10.55,;10.67,-9.24,;12.21,-9.29,;10.67,-7.7,;9.34,-6.93,;8,-7.7,;6.67,-6.93,;6.67,-5.39,;8,-4.62,;8,-3.08,;6.67,-2.31,;5.33,-3.08,;5.33,-4.62,;6.67,-.77,;8,,;8,1.54,;6.67,2.31,;6.67,3.85,;8,4.62,;5.33,4.62,;5.33,6.16,;5.33,7.7,;6.87,6.16,;3.79,6.16,;3.02,4.83,;1.48,4.83,;.71,6.16,;-.83,6.16,;-1.6,4.83,;-3.14,4.83,;-2.27,3.55,;-4.44,4.01,;-5.8,4.73,;-5.85,6.27,;-4.55,7.09,;-3.19,6.37,;-7.21,7,;-7.27,8.53,;-8.63,9.26,;-8.68,10.8,;-8.74,12.34,;-8.52,6.18,;-9.24,4.82,;-10.06,6.13,;1.48,7.49,;3.02,7.49,;.71,8.83,;1.48,10.16,;-.83,8.83,;5.33,1.54,;4,2.31,;2.67,1.54,;2.67,,;1.33,-.77,;;-1.46,-.48,;-2.37,.77,;-1.46,2.02,;,1.54,;1.33,2.31,;5.33,,;8,-9.24,;9.34,-10.01,;6.67,-10.01,;6.67,-11.55,;5.33,-12.32,;4,-11.55,;2.67,-12.32,;4,-10.01,;5.33,-9.24,)|
BDBM189791 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3cnc(NCC4CCOCC4)c(c3)[N+]([O-])=O)c(Oc3cnc4[nH]ccc4c3)c2)=C(C1)c1ccc(Cl)cc1 |c:57|
BDBM189792 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(NCC4CCC5(COC5)CC4)c(c3)[N+]([O-])=O)c(Oc3cnc4[nH]ccc4c3)c2)=C(C1)c1ccc(Cl)cc1 |c:61|
BDBM55855 COc1ccc(C(=O)N2Cc3ccccc3C[C@H]2CN2CCOCC2)c(c1)-c1cc(C(=O)N(c2ccccc2)c2ccc(O)cc2)c(C)n1C
BDBM60408 Cc1c(cc(-c2cc3OCOc3cc2C(=O)N2Cc3ccccc3C[C@H]2CN2CCOCC2)n1C)C(=O)N(c1ccncc1)c1ccc(O)cc1
BDBM60409 CN1CCN(C[C@@H]2Cc3ccccc3CN2C(=O)c2cc3OCOc3cc2-c2cc(C(=O)N(N3CCN(C)CC3)c3ccc(O)cc3)c(n2C)C(F)(F)F)CC1
BDBM177840 Cn1ccc2cc(ccc12)N(C(=O)c1cc(-c2cc3OCOc3cc2C(=O)N2Cc3ccccc3C[C@H]2CN2CCOCC2)n2ccccc12)c1ccc(O)cc1
BDBM177841 CCn1ccc2cc(ccc12)N(C(=O)c1cc(-c2cc3OCOc3cc2C(=O)N2Cc3ccccc3C[C@H]2CN2CCOCC2)n2ccccc12)c1ccc(O)cc1
BDBM177842 CN1CCc2cc(ccc12)N(C(=O)c1cc(-c2cc3OCOc3cc2C(=O)N2Cc3ccccc3C[C@H]2CN2CCOCC2)n2ccccc12)c1ccc(O)cc1
BDBM177843 CC(C)n1ccc2cc(ccc12)N(C(=O)c1cc(-c2cc3OCOc3cc2C(=O)N2Cc3ccccc3C[C@H]2CN2CCOCC2)n2ccccc12)c1ccc(O)cc1
BDBM189588 CC1(C)CCCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(NCC4CCOCC4)c(c3)[N+]([O-])=O)c(Oc3cnc4[nH]ccc4c3)c2)=C1c1ccc(Cl)cc1 |c:58|
BDBM189589 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(NC4CN(C4)C(CF)CF)c(c3)[N+]([O-])=O)c(Oc3cnc4[nH]ccc4c3)c2)=C(C1)c1ccc(Cl)cc1 |c:59|
BDBM189590 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(NCC4CCN(C4)S(C)(=O)=O)c(c3)[N+]([O-])=O)c(Oc3cnc4[nH]ccc4c3)c2)=C(C1)c1ccc(Cl)cc1 |c:60|
BDBM189639 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(OCC4CCCC(=O)C4)c(c3)[N+]([O-])=O)c(Oc3cnc4[nH]ccc4c3)c2)=C(C1)c1ccc(Cl)cc1 |c:58|
BDBM189640 CC1(C)CC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(NCC4CCOCC4)c(c3)[N+]([O-])=O)c(Oc3cnc4[nH]ccc4c3)c2)=C(C=C1)c1ccc(Cl)cc1 |c:56,58|
BDBM189641 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(N[C@@H]4CCN(C4)C(CF)CF)c(c3)[N+]([O-])=O)c(Oc3cnc4[nH]ccc4c3)c2)=C(C1)c1ccc(Cl)cc1 |c:60|
BDBM189750 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(NCCCN(C4CC4)C4CCC4)c(c3)[N+]([O-])=O)c(Oc3cnc4[nH]ccc4c3)c2)=C(C1)c1ccc(Cl)cc1 |c:62|
BDBM189751 [O-][N+](=O)c1cc(ccc1NCC1CCOCC1)S(=O)(=O)NC(=O)c1ccc(cc1Oc1cnc2[nH]ccc2c1)N1CCN(CC2=C(CCC(F)(F)C2)c2ccc(Cl)cc2)CC1 |t:49|
BDBM189752 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(OCC4(F)CCN(CC4)C4COC4)c(Cl)c3)c(Oc3cnc4[nH]ccc4c3)c2)=C(C1)c1ccc(Cl)cc1 |c:61|
BDBM189658 CC(C)N1CCC(CC1)Nc1ccc(cc1[N+]([O-])=O)S(=O)(=O)NC(=O)c1ccc(cc1Oc1cnc2[nH]ccc2c1)N1CCN(CC2=C(CC(C)(C)CC2)c2ccc(Cl)cc2)CC1 |t:51|
BDBM189657 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(N[C@@H]4CCN(C4)C(CF)CF)c(c3)S(=O)(=O)C(F)(F)F)c(Oc3cnc4[nH]ccc4c3)c2)=C(C1)c1ccc(Cl)cc1 |c:64|
BDBM189659 CC(C)(C)N1CCC(CC1)Nc1ccc(cc1[N+]([O-])=O)S(=O)(=O)NC(=O)c1ccc(cc1Oc1cnc2[nH]ccc2c1)N1CCN(CC2=C(CC(C)(C)CC2)c2ccc(Cl)cc2)CC1 |t:52|
BDBM189678 CN(C)CC(=O)N1CCO[C@@H](COc2ncc(cc2Cl)S(=O)(=O)NC(=O)c2ccc(cc2Oc2cnc3[nH]ccc3c2)N2CCN(CC3=C(CC(C)(C)CC3)c3ccc(Cl)cc3)CC2)C1 |t:51|
BDBM189679 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3cnc(OCC4(F)CCOCC4)c(F)c3)c(Oc3cnc4[nH]ccc4c3)c2)=C(C1)c1ccc(Cl)cc1 |c:56|
BDBM177844 CCN1CCc2cc(ccc12)N(C(=O)c1cc(-c2cc3OCOc3cc2C(=O)N2Cc3ccccc3C[C@H]2CN2CCOCC2)n2ccccc12)c1ccc(O)cc1
BDBM177845 CC(C)N1CCc2cc(ccc12)N(C(=O)c1cc(-c2cc3OCOc3cc2C(=O)N2Cc3ccccc3C[C@H]2CN2CCOCC2)n2ccccc12)c1ccc(O)cc1
BDBM177846 CN1CCN(C[C@@H]2Cc3ccccc3CN2C(=O)c2ccc(Cl)cc2-c2cc(C(=O)N(c3ccc(O)cc3)c3ccc4n(C)ccc4c3)c3ccccn23)CC1
BDBM177847 CN1CCc2cc(ccc12)N(C(=O)c1cc(-c2cc(Cl)ccc2C(=O)N2Cc3ccccc3C[C@H]2CN2CCOCC2)n2ccccc12)c1ccc(O)cc1
BDBM50030749 OC(=O)c1nc(sc1CCCOc1cccc(c1)-n1ncc2cncnc12)N1CCc2cccc(C(=O)Nc3nc4ccccc4s3)c2C1
BDBM189591 CC(=O)N1CCC(CNc2ccc(cc2[N+]([O-])=O)S(=O)(=O)NC(=O)c2ccc(cc2Oc2cnc3[nH]ccc3c2)N2CCN(CC3=C(CC(C)(C)CC3)c3ccc(Cl)cc3)CC2)C1 |t:49|
BDBM189592 CC(=O)N1CC[C@H](C1)Nc1ccc(cc1[N+]([O-])=O)S(=O)(=O)NC(=O)c1ccc(cc1Oc1cnc2[nH]ccc2c1)N1CCN(CC2=C(CC(C)(C)CC2)c2ccc(Cl)cc2)CC1 |t:50|
BDBM189593 COCC(C)(C)CNc1ccc(cc1[N+]([O-])=O)S(=O)(=O)NC(=O)c1ccc(cc1Oc1cnc2[nH]ccc2c1)N1CCN(CC2=C(CC(C)(C)CC2)c2ccc(Cl)cc2)CC1 |t:48|
BDBM189642 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3cnc(OCC4(F)CCOCC4)c(c3)C(F)(F)F)c(Oc3cnc4[nH]ccc4c3)c2)=C(C1)c1ccc(Cl)cc1 |c:59|
BDBM189753 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(OCC4CCOC4)c(Cl)c3)c(Oc3cnc4[nH]ccc4c3)c2)=C(C1)c1ccc(Cl)cc1 |c:54|
BDBM189754 O[C@H]1CC[C@H](CNc2ccc(cc2[N+]([O-])=O)S(=O)(=O)NC(=O)c2ccc(cc2Oc2cnc3[nH]ccc3c2)N2CCN(CC3=C(CCC(F)(F)C3)c3ccc(Cl)cc3)CC2)CC1 |wU:4.4,wD:1.0,t:47,(-11.34,6.22,;-9.8,6.22,;-9.03,4.89,;-7.49,4.89,;-6.72,6.22,;-5.18,6.22,;-4.41,7.56,;-2.87,7.56,;-2.1,6.22,;-.56,6.22,;.21,7.56,;-.56,8.89,;-2.1,8.89,;-2.87,10.22,;-2.1,11.56,;-4.41,10.22,;1.75,7.56,;1.75,9.1,;3.29,7.56,;1.75,6.02,;3.08,5.25,;4.42,6.02,;3.08,3.71,;4.42,2.94,;4.42,1.4,;3.08,.63,;1.75,1.4,;1.75,2.94,;.42,3.71,;-.92,2.94,;-.92,1.4,;-2.25,.63,;-3.58,1.4,;-5.05,.92,;-5.95,2.17,;-5.05,3.41,;-3.58,2.94,;-2.25,3.71,;3.08,-.91,;4.42,-1.68,;4.42,-3.22,;3.08,-3.99,;3.08,-5.53,;4.42,-6.3,;4.42,-7.84,;5.75,-8.61,;7.08,-7.84,;7.08,-6.3,;8.62,-6.25,;7.9,-5,;5.75,-5.53,;3.08,-8.61,;3.08,-10.15,;1.75,-10.92,;.42,-10.15,;-.92,-10.92,;.42,-8.61,;1.75,-7.84,;1.75,-3.22,;1.75,-1.68,;-7.49,7.56,;-9.03,7.56,)|
BDBM189755 FC1(COc2ccc(cc2Cl)S(=O)(=O)NC(=O)c2ccc(cc2Oc2cnc3[nH]ccc3c2)N2CCN(CC3=C(CCC4(CCN(CC4)C4COC4)C3)c3ccc(Cl)cc3)CC2)CCOCC1 |t:42|
BDBM189804 COC1(C)CCC(=C(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(NCC4CCOCC4)c(c3)[N+]([O-])=O)c(Oc3cnc4[nH]ccc4c3)c2)C1)c1ccc(Cl)cc1 |t:6|
BDBM189463 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(NC4CCC(CC4)N4CCOCC4)c(c3)[N+]([O-])=O)c(Oc3cnc4[nH]ccc4c3)c2)=C(C1)c1ccc(Cl)cc1 |c:63,(8.32,-14.13,;7.51,-12.83,;9.04,-12.88,;7.51,-11.29,;6.17,-10.52,;4.84,-11.29,;3.5,-10.52,;3.5,-8.98,;4.84,-8.21,;4.84,-6.67,;3.5,-5.9,;2.17,-6.67,;2.17,-8.21,;3.5,-4.36,;4.84,-3.59,;4.84,-2.05,;3.5,-1.28,;3.5,.26,;2.17,1.03,;4.84,1.03,;4.84,2.57,;6.38,2.57,;3.3,2.57,;4.84,4.11,;3.5,4.88,;3.5,6.42,;4.84,7.19,;4.84,8.73,;3.5,9.5,;2.17,8.73,;.84,9.5,;.84,11.04,;2.17,11.81,;3.5,11.04,;-.5,11.81,;-1.83,11.04,;-3.16,11.81,;-3.16,13.35,;-1.83,14.12,;-.5,13.35,;6.17,6.42,;6.17,4.88,;7.51,7.19,;7.51,8.73,;8.84,6.42,;2.17,-2.05,;.84,-1.28,;-.5,-2.05,;-.5,-3.59,;-1.83,-4.36,;-3.16,-3.59,;-4.63,-4.06,;-5.53,-2.82,;-4.63,-1.57,;-3.16,-2.05,;-1.83,-1.28,;2.17,-3.59,;4.84,-12.83,;6.17,-13.6,;3.5,-13.6,;3.5,-15.14,;2.17,-15.91,;.84,-15.14,;-.5,-15.91,;.84,-13.6,;2.17,-12.83,)|
BDBM189767 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(NCC4CCC(C)(O)CC4)c(c3)[N+]([O-])=O)c(Oc3cnc4[nH]ccc4c3)c2)=C(C1)c1ccc(Cl)cc1 |c:59,(8.08,-9.06,;7.26,-7.76,;8.8,-7.81,;7.26,-6.22,;5.93,-5.45,;4.59,-6.22,;3.26,-5.45,;3.26,-3.91,;4.59,-3.14,;4.59,-1.6,;3.26,-.83,;1.92,-1.6,;1.92,-3.14,;3.26,.71,;4.59,1.48,;4.59,3.02,;3.26,3.79,;3.26,5.33,;4.59,6.1,;1.92,6.1,;1.92,7.64,;1.92,9.18,;3.46,7.64,;.38,7.64,;-.39,6.31,;-1.93,6.31,;-2.7,7.64,;-4.24,7.64,;-5.01,6.31,;-6.55,6.31,;-7.32,4.97,;-8.86,4.97,;-9.63,6.31,;-10.99,5.59,;-10.99,7.03,;-8.86,7.64,;-7.32,7.64,;-1.93,8.98,;-.39,8.98,;-2.7,10.31,;-1.93,11.64,;-4.24,10.31,;1.92,3.02,;.59,3.79,;-.74,3.02,;-.74,1.48,;-2.08,.71,;-3.41,1.48,;-4.87,1.01,;-5.78,2.25,;-4.87,3.5,;-3.41,3.02,;-2.08,3.79,;1.92,1.48,;4.59,-7.76,;5.93,-8.53,;3.26,-8.53,;3.26,-10.07,;1.92,-10.84,;.59,-10.07,;-.74,-10.84,;.59,-8.53,;1.92,-7.76,)|
BDBM189660 COCCN1CCCC(CNc2ccc(cc2[N+]([O-])=O)S(=O)(=O)NC(=O)c2ccc(cc2Oc2cnc3[nH]ccc3c2)N2CCN(CC3=C(CC(C)(C)CC3)c3ccc(Cl)cc3)CC2)C1 |t:51|
BDBM189661 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(NCC4CCCN(CC#N)C4)c(c3)[N+]([O-])=O)c(Oc3cnc4[nH]ccc4c3)c2)=C(C1)c1ccc(Cl)cc1 |c:60|
BDBM189662 CN1CCC(F)(COc2ccc(cc2S(=O)(=O)C(F)(F)F)S(=O)(=O)NC(=O)c2ccc(cc2Oc2cnc3[nH]ccc3c2)N2CCN(CC3=C(CC(C)(C)CC3)c3ccc(Cl)cc3)CC2)CC1 |t:52|
BDBM189680 CC(CO)(CO)COc1ncc(cc1Cl)S(=O)(=O)NC(=O)c1ccc(cc1Oc1cnc2[nH]ccc2c1)N1CCN(CC2=C(CC(C)(C)CC2)c2ccc(Cl)cc2)CC1 |t:46|
BDBM189681 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(OCC4(F)CCOCC4)nc3)c(Oc3cnc4[nH]ccc4c3)c2)=C(C1)c1ccc(Cl)cc1 |c:55|
BDBM189682 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(NCC4CN(CCO4)C(CF)CF)c(c3)[N+]([O-])=O)c(Oc3cnc4[nH]ccc4c3)c2)=C(C1)c1ccc(Cl)cc1 |c:62|
BDBM177787 Cc1ccc(cc1)N(C(=O)c1cc(-c2cc3OCOc3cc2C(=O)N2Cc3ccccc3C[C@H]2CN2CCOCC2)n2CCCCc12)c1ccc(O)cc1
BDBM177848 Cn1ccc2cc(ccc12)N(C(=O)c1cc(-c2cc(Cl)ccc2C(=O)N2Cc3ccccc3C[C@H]2CN2CCOCC2)n2ccccc12)c1ccc(O)cc1
BDBM177849 CN1CCCc2cc(ccc12)N(C(=O)c1cc(-c2cc3OCCOc3cc2C(=O)N2Cc3ccccc3C[C@H]2CN2CCOCC2)n2ccccc12)c1ccc(O)cc1
BDBM177850 Cn1ccc2cc(ccc12)N(C(=O)c1cc(-c2cc3OCCOc3cc2C(=O)N2Cc3ccccc3C[C@H]2CN2CCOCC2)n2ccccc12)c1ccc(O)cc1
BDBM177851 COc1ccc(C(=O)N2Cc3ccccc3C[C@H]2CN2CCOCC2)c(c1)-c1cc(C(=O)N(c2ccc(O)cc2)c2ccc3n(C)ccc3c2)c2ccccn12
BDBM189594 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(NC[C@@H]4CC[C@@H](O)C4)c(c3)[N+]([O-])=O)c(Oc3cnc4[nH]ccc4c3)c2)=C(C1)c1ccc(Cl)cc1 |c:57|
BDBM189772 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(OCC4CCC(C)(O)CC4)c(c3)[N+]([O-])=O)c(Oc3cnc4[nH]ccc4c3)c2)=C(C1)c1ccc(Cl)cc1 |c:59,(8.08,-9.06,;7.26,-7.76,;8.8,-7.81,;7.26,-6.22,;5.93,-5.45,;4.59,-6.22,;3.26,-5.45,;3.26,-3.91,;4.59,-3.14,;4.59,-1.6,;3.26,-.83,;1.92,-1.6,;1.92,-3.14,;3.26,.71,;4.59,1.48,;4.59,3.02,;3.26,3.79,;3.26,5.33,;4.59,6.1,;1.92,6.1,;1.92,7.64,;1.92,9.18,;3.46,7.64,;.38,7.64,;-.39,6.31,;-1.93,6.31,;-2.7,7.64,;-4.24,7.64,;-5.01,6.31,;-6.55,6.31,;-7.32,4.97,;-8.86,4.97,;-9.63,6.31,;-10.99,5.59,;-10.99,7.03,;-8.86,7.64,;-7.32,7.64,;-1.93,8.98,;-.39,8.98,;-2.7,10.31,;-1.93,11.64,;-4.24,10.31,;1.92,3.02,;.59,3.79,;-.74,3.02,;-.74,1.48,;-2.08,.71,;-3.41,1.48,;-4.87,1.01,;-5.78,2.25,;-4.87,3.5,;-3.41,3.02,;-2.08,3.79,;1.92,1.48,;4.59,-7.76,;5.93,-8.53,;3.26,-8.53,;3.26,-10.07,;1.92,-10.84,;.59,-10.07,;-.74,-10.84,;.59,-8.53,;1.92,-7.76,)|
BDBM189646 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(NC4CCN(C4)C4COC4)c(c3)[N+]([O-])=O)c(Oc3cnc4[nH]ccc4c3)c2)=C(C1)c1ccc(Cl)cc1 |c:60|
BDBM189647 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(NCC4CN(CC#N)CCO4)c(c3)[N+]([O-])=O)c(Oc3cnc4[nH]ccc4c3)c2)=C(C1)c1ccc(Cl)cc1 |c:60|
BDBM189756 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(NC[C@@H]4CN(CCO4)C4CC4)c(c3)[N+]([O-])=O)c(Oc3cnc4[nH]ccc4c3)c2)=C(C1)c1ccc(Cl)cc1 |c:61|
BDBM189757 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(NC[C@H]4CN(CCO4)C4CC4)c(c3)[N+]([O-])=O)c(Oc3cnc4[nH]ccc4c3)c2)=C(C1)c1ccc(Cl)cc1 |c:61|
BDBM189758 [O-][N+](=O)c1cc(ccc1NCC1CCOCC1)S(=O)(=O)NC(=O)c1ccc(cc1Oc1cnc2[nH]ccc2c1)N1CCN(CC2=C(CC3(CC3)CC2)c2ccc(Cl)cc2)CC1 |t:49|
BDBM189663 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3cnc(N[C@@H]4CCN(C4)C(CF)CF)c(Cl)c3)c(Oc3cnc4[nH]ccc4c3)c2)=C(C1)c1ccc(Cl)cc1 |c:58|
BDBM189664 CC(C)(C)OC(=O)N1CCN(CC1)Nc1ccc(cc1[N+]([O-])=O)S(=O)(=O)NC(=O)c1ccc(cc1Oc1cnc2[nH]ccc2c1)N1CCN(CC2=C(CC(C)(C)CC2)c2ccc(Cl)cc2)CC1 |t:55|
BDBM189665 COC1(COc2ccc(cc2[N+]([O-])=O)S(=O)(=O)NC(=O)c2ccc(cc2Oc2cnc3[nH]ccc3c2)N2CCN(CC3=C(CC(C)(C)CC3)c3ccc(Cl)cc3)CC2)CCOCC1 |t:45|
BDBM189683 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3cnc(OCC4CCN(CC#N)CC4)c(Cl)c3)c(Oc3cnc4[nH]ccc4c3)c2)=C(C1)c1ccc(Cl)cc1 |c:58|
BDBM189684 COCCOCCN1CC[C@H](C1)Nc1ccc(cc1[N+]([O-])=O)S(=O)(=O)NC(=O)c1ccc(cc1Oc1cnc2[nH]ccc2c1)N1CCN(CC2=C(CC(C)(C)CC2)c2ccc(Cl)cc2)CC1 |t:54|
BDBM189685 CN(C)CC(=O)N1CC[C@H](C1)Nc1ccc(cc1[N+]([O-])=O)S(=O)(=O)NC(=O)c1ccc(cc1Oc1cnc2[nH]ccc2c1)N1CCN(CC2=C(CC(C)(C)CC2)c2ccc(Cl)cc2)CC1 |t:53|
BDBM177788 Oc1ccc(cc1)N(C(=O)c1cc(-c2cc3OCOc3cc2C(=O)N2Cc3ccccc3C[C@H]2CN2CCOCC2)n2CCCCc12)c1ccc(Cl)cc1
BDBM177790 Oc1ccc(cc1)N(C(=O)c1cc(-c2cc3OCOc3cc2C(=O)N2Cc3ccccc3C[C@H]2CN2CCOCC2)n2CCCCc12)c1ccc(OC(F)(F)F)cc1
BDBM177791 Oc1ccc(cc1)N(C(=O)c1cc(-c2cc3OCOc3cc2C(=O)N2Cc3ccccc3C[C@H]2CN2CCOCC2)n2CCCCc12)c1ccc(O)cc1
BDBM177852 Cn1ccc2cc(ccc12)N(C(=O)c1cc(-c2cc3OCOc3cc2C(=O)N2Cc3ccccc3C[C@H]2CN2CCOCC2)n2CCN(Cc12)C(=O)OC(C)(C)C)c1ccc(O)cc1
BDBM177853 Cn1ccc2cc(ccc12)N(C(=O)c1cc(-c2cc3OCOc3cc2C(=O)N2Cc3ccccc3C[C@H]2CN2CCOCC2)n2CCNCc12)c1ccc(O)cc1
BDBM177854 CN1CCN(C[C@@H]2Cc3ccccc3CN2C(=O)c2cc3OCOc3cc2-c2cc(C(=O)N(c3ccc(O)cc3)c3ccc4n(C)ccc4c3)c3CCCn23)CC1
BDBM177855 CN1CCN(C[C@@H]2Cc3ccccc3CN2C(=O)c2ccc(Cl)cc2-c2cc(C(=O)N(c3ccc(O)cc3)c3ccc4n(C)ccc4c3)c3CCCn23)CC1
BDBM189598 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(N[C@H]4CCCNC4=O)c(c3)[N+]([O-])=O)c(Oc3cnc4[nH]ccc4c3)c2)=C(C1)c1ccc(Cl)cc1 |c:57|
BDBM189599 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(NCC4CN(C4)C(CF)CF)c(c3)[N+]([O-])=O)c(Oc3cnc4[nH]ccc4c3)c2)=C(C1)c1ccc(Cl)cc1 |c:60|
BDBM189648 CN(C)CC(=O)N1CCOC(CNc2ccc(cc2[N+]([O-])=O)S(=O)(=O)NC(=O)c2ccc(cc2Oc2cnc3[nH]ccc3c2)N2CCN(CC3=C(CC(C)(C)CC3)c3ccc(Cl)cc3)CC2)C1 |t:53|
BDBM189649 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(NCC4CN(CC(O)=O)CCO4)c(c3)[N+]([O-])=O)c(Oc3cnc4[nH]ccc4c3)c2)=C(C1)c1ccc(Cl)cc1 |c:61|
BDBM189650 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(NCC4CN(CCO4)C4COC4)c(c3)[N+]([O-])=O)c(Oc3cnc4[nH]ccc4c3)c2)=C(C1)c1ccc(Cl)cc1 |c:62|
BDBM189759 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3cnc(OCC4CCC(CC4)N(C4CC4)C4COC4)c(Cl)c3)c(Oc3cnc4[nH]ccc4c3)c2)=C(C1)c1ccc(Cl)cc1 |c:65,(1.85,-10.55,;2.67,-9.24,;1.13,-9.29,;2.67,-7.7,;4,-6.93,;5.33,-7.7,;6.67,-6.93,;6.67,-5.39,;8,-4.62,;8,-3.08,;6.67,-2.31,;5.33,-3.08,;5.33,-4.62,;6.67,-.77,;8,,;8,1.54,;6.67,2.31,;6.67,3.85,;5.33,4.62,;8,4.62,;9.34,3.85,;10.11,5.18,;8.57,2.52,;10.67,3.08,;10.67,1.54,;12,.77,;13.34,1.54,;14.67,.77,;16,1.54,;17.34,.77,;18.67,1.54,;20.01,.77,;20.01,-.77,;18.67,-1.54,;17.34,-.77,;21.34,-1.54,;21.34,-3.08,;22.11,-4.41,;20.57,-4.41,;22.67,-.77,;24.16,-1.17,;24.56,.32,;23.07,.72,;13.34,3.08,;14.67,3.85,;12,3.85,;5.33,1.54,;4,2.31,;2.67,1.54,;2.67,,;1.33,-.77,;;-1.46,-.48,;-2.37,.77,;-1.46,2.02,;,1.54,;1.33,2.31,;5.33,,;5.33,-9.24,;4,-10.01,;6.67,-10.01,;8,-9.24,;9.34,-10.01,;9.34,-11.55,;10.67,-12.32,;8,-12.32,;6.67,-11.55,)|
BDBM189760 [O-][N+](=O)c1cc(ccc1NCC1CN(CCO1)C1CC1)S(=O)(=O)NC(=O)c1ccc(cc1Oc1cnc2[nH]ccc2c1)N1CCN(CC2=C(CC3(CC3)CC2)c2ccc(Cl)cc2)CC1 |t:53|
BDBM189761 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(OCC4CN(CCO4)C4CC4)c(Cl)c3)c(Oc3cnc4[nH]ccc4c3)c2)=C(C1)c1ccc(Cl)cc1 |c:59|
BDBM189666 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(O[C@@H]4CCN(C4)C(CF)CF)c(c3)[N+]([O-])=O)c(Oc3cnc4[nH]ccc4c3)c2)=C(C1)c1ccc(Cl)cc1 |c:60|
BDBM189667 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(NN4CCN(CC4)C4COC4)c(c3)[N+]([O-])=O)c(Oc3cnc4[nH]ccc4c3)c2)=C(C1)c1ccc(Cl)cc1 |c:61|
BDBM189686 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(NC4CN(C4)C4COC4)c(c3)[N+]([O-])=O)c(Oc3cnc4[nH]ccc4c3)c2)=C(C1)c1ccc(Cl)cc1 |c:59|
BDBM189687 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3cnc(OCC4(F)CCN(CC#N)CC4)c(Cl)c3)c(Oc3cnc4[nH]ccc4c3)c2)=C(C1)c1ccc(Cl)cc1 |c:59|
BDBM189688 CN(C)CC(=O)N1CCO[C@H](CNc2ccc(cc2[N+]([O-])=O)S(=O)(=O)NC(=O)c2ccc(cc2Oc2cnc3[nH]ccc3c2)N2CCN(CC3=C(CC(C)(C)CC3)c3ccc(Cl)cc3)CC2)C1 |t:53|
BDBM177792 Oc1ccc(cc1)N(C(=O)c1cc(-c2cc3OCOc3cc2C(=O)N2Cc3ccccc3C[C@H]2CN2CCOCC2)n2CCCCc12)c1ccc2NCCc2c1
BDBM177793 CN1CCc2cc(ccc12)N(C(=O)c1cc(-c2cc3OCOc3cc2C(=O)N2Cc3ccccc3C[C@H]2CN2CCOCC2)n2CCCCc12)c1ccc(O)cc1
BDBM177795 CN1CCN(C[C@@H]2Cc3ccccc3CN2C(=O)c2cc3OCOc3cc2-c2cc(C(=O)N(c3ccc(O)cc3)c3ccc4n(C)ccc4c3)c3CCCCn23)CC1
BDBM177856 Oc1ccc(cc1)N(C(=O)c1cc(-c2cc(Cl)ccc2C(=O)N2Cc3ccccc3C[C@H]2CN2CCOCC2)n2CCOCc12)c1ccccc1
BDBM177857 Oc1ccc(cc1)N(C(=O)c1cc(-c2cc(Cl)ccc2C(=O)N2Cc3ccccc3C[C@H]2CN2CCOCC2)n2CCOCc12)c1ccc2NCCc2c1
BDBM177858 Cn1ccc2cc(ccc12)N(C(=O)c1cc(-c2cc3OCOc3cc2C(=O)N2Cc3ccccc3C[C@H]2CN2CCOCC2)n2CCOCc12)c1ccc(O)cc1
BDBM177859 CN1CCc2cc(ccc12)N(C(=O)c1cc(-c2cc3OCOc3cc2C(=O)N2Cc3ccccc3C[C@H]2CN2CCOCC2)n2CCOCc12)c1ccc(O)cc1
BDBM189556 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(NC[C@H]4CCN(C4)C4CCOCC4)c(c3)[N+]([O-])=O)c(Oc3cnc4[nH]ccc4c3)c2)=C(C1)c1ccc(Cl)cc1 |c:63|
BDBM189557 CC1(C)CCC(=C(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(OCC4(F)CCOCC4)c(c3)[N+]([O-])=O)c(Oc3cnc4[nH]ccc4c3)c2)C1)c1ccc(Cl)cc1 |t:5|
BDBM189600 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(NCC4CN(C4)C4COC4)c(c3)[N+]([O-])=O)c(Oc3cnc4[nH]ccc4c3)c2)=C(C1)c1ccc(Cl)cc1 |c:60|
BDBM189601 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(NCC4CCN(CC4)C4COC4)c(c3)[N+]([O-])=O)c(Oc3cnc4[nH]ccc4c3)c2)=C(C1)c1ccc(Cl)cc1 |c:62|
BDBM189602 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(NCC4CCN(CC4)C4CC4)c(c3)[N+]([O-])=O)c(Oc3cnc4[nH]ccc4c3)c2)=C(C1)c1ccc(Cl)cc1 |c:61|
BDBM189651 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(NCC4CN(CCO4)C4CC4)c(c3)[N+]([O-])=O)c(Oc3cnc4[nH]ccc4c3)c2)=C(C1)c1ccc(Cl)cc1 |c:61|
BDBM189652 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3cnc(OCC4CCOCC4)c(c3)S(C)(=O)=O)c(Oc3cnc4[nH]ccc4c3)c2)=C(C1)c1ccc(Cl)cc1 |c:58|
BDBM189653 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(OCC4(F)CCOCC4)c(c3)S(=O)(=O)C(F)(F)F)c(Oc3cnc4[nH]ccc4c3)c2)=C(C1)c1ccc(Cl)cc1 |c:62|
BDBM189762 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(NCC4CN(CCO4)C4CC4)c(Cl)c3)c(Oc3cnc4[nH]ccc4c3)c2)=C(C1)c1ccc(Cl)cc1 |c:59|
BDBM189763 CCN(C)C(=O)N1CCOC(CNc2ccc(cc2Cl)S(=O)(=O)NC(=O)c2ccc(cc2Oc2cnc3[nH]ccc3c2)N2CCN(CC3=C(CC(C)(C)CC3)c3ccc(Cl)cc3)CC2)C1 |t:51|
BDBM189764 CCN(C)C(=O)N1CCO[C@H](COc2ncc(cc2Cl)S(=O)(=O)NC(=O)c2ccc(cc2Oc2cnc3[nH]ccc3c2)N2CCN(CC3=C(CC(C)(C)CC3)c3ccc(Cl)cc3)CC2)C1 |t:51|
BDBM189689 CN(C)CC(=O)N1CCO[C@@H](CNc2ccc(cc2[N+]([O-])=O)S(=O)(=O)NC(=O)c2ccc(cc2Oc2cnc3[nH]ccc3c2)N2CCN(CC3=C(CC(C)(C)CC3)c3ccc(Cl)cc3)CC2)C1 |t:53|
BDBM189690 CN(C)CC(=O)N1CCC(COc2ncc(cc2Cl)S(=O)(=O)NC(=O)c2ccc(cc2Oc2cnc3[nH]ccc3c2)N2CCN(CC3=C(CC(C)(C)CC3)c3ccc(Cl)cc3)CC2)CC1 |t:50|
BDBM189691 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3cnc(O[C@@H]4CCN(CC(F)F)C4)c(Cl)c3)c(Oc3cnc4[nH]ccc4c3)c2)=C(C1)c1ccc(Cl)cc1 |c:57|
BDBM177796 Cn1ccc2cc(ccc12)N(C(=O)c1cc(-c2cc3OCOc3cc2C(=O)N2Cc3ccccc3C[C@H]2CN2CCCOCC2)n2CCCCc12)c1ccc(O)cc1
BDBM177797 C[C@@H]1COCCN1C[C@@H]1Cc2ccccc2CN1C(=O)c1cc2OCOc2cc1-c1cc(C(=O)N(c2ccc(O)cc2)c2ccc3n(C)ccc3c2)c2CCCCn12
BDBM177798 C[C@H]1COCCN1C[C@@H]1Cc2ccccc2CN1C(=O)c1cc2OCOc2cc1-c1cc(C(=O)N(c2ccc(O)cc2)c2ccc3n(C)ccc3c2)c2CCCCn12
BDBM177799 C[C@H]1COC[C@H](C)N1C[C@@H]1Cc2ccccc2CN1C(=O)c1cc2OCOc2cc1-c1cc(C(=O)N(c2ccc(O)cc2)c2ccc3n(C)ccc3c2)c2CCCCn12
BDBM177860 Cc1ccc(cc1F)N(C(=O)c1cc(-c2cc(Cl)ccc2C(=O)N2Cc3ccccc3C[C@H]2CN2CCOCC2)n2CCOCc12)c1ccc(O)cc1
BDBM177861 Cn1ccc2ccc(cc12)N(C(=O)c1cc(-c2cc(Cl)ccc2C(=O)N2Cc3ccccc3C[C@H]2CN2CCOCC2)n2CCCCCc12)c1ccc(O)cc1
BDBM177862 Cn1ccc2ccc(cc12)N(C(=O)c1cc(-c2cc3OCOc3cc2C(=O)N2Cc3ccccc3C[C@H]2CN2CCOCC2)n2CCCCCc12)c1ccc(O)cc1
BDBM177863 Oc1ccc(cc1)N(C(=O)c1cc(-c2cc(Cl)ccc2C(=O)N2Cc3ccccc3C[C@H]2CN2CCOCC2)n2CCCCc12)c1ccsc1
BDBM189558 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(OC[C@H]4CC[C@H](O)CC4)c(c3)[N+]([O-])=O)c(Oc3cnc4[nH]ccc4c3)c2)=C(C1)c1ccc(Cl)cc1 |wU:29.29,wD:32.33,c:58,(7.36,-9.37,;6.55,-8.07,;8.09,-8.12,;6.55,-6.53,;5.21,-5.76,;3.88,-6.53,;2.55,-5.76,;2.55,-4.22,;3.88,-3.45,;3.88,-1.91,;2.55,-1.14,;1.21,-1.91,;1.21,-3.45,;2.55,.4,;3.88,1.17,;3.88,2.71,;2.55,3.48,;2.55,5.02,;3.88,5.79,;1.21,5.79,;1.21,7.33,;1.21,8.87,;2.75,7.33,;-.33,7.33,;-1.1,6,;-2.64,6,;-3.41,7.33,;-4.95,7.33,;-5.72,6,;-7.26,6,;-8.03,4.67,;-9.57,4.67,;-10.34,6,;-11.88,6,;-9.57,7.33,;-8.03,7.33,;-2.64,8.67,;-1.1,8.67,;-3.41,10,;-2.64,11.34,;-4.95,10,;1.21,2.71,;-.12,3.48,;-1.46,2.71,;-1.46,1.17,;-2.79,.4,;-4.12,1.17,;-5.59,.7,;-6.49,1.94,;-5.59,3.19,;-4.12,2.71,;-2.79,3.48,;1.21,1.17,;3.88,-8.07,;5.21,-8.84,;2.55,-8.84,;2.55,-10.38,;1.21,-11.15,;-.12,-10.38,;-1.46,-11.15,;-.12,-8.84,;1.21,-8.07,)|
BDBM189559 CO[C@@H]1CC[C@H](COc2ccc(cc2[N+]([O-])=O)S(=O)(=O)NC(=O)c2ccc(cc2Oc2cnc3[nH]ccc3c2)N2CCN(CC3=C(CC(C)(C)CC3)c3ccc(Cl)cc3)CC2)CC1 |wU:2.1,5.5,t:48,(-12.33,7.22,;-11.56,5.88,;-10.02,5.88,;-9.25,4.55,;-7.71,4.55,;-6.94,5.88,;-5.4,5.88,;-4.63,7.22,;-3.09,7.22,;-2.32,5.88,;-.78,5.88,;-.01,7.22,;-.78,8.55,;-2.32,8.55,;-3.09,9.88,;-2.32,11.22,;-4.63,9.88,;1.53,7.22,;1.53,8.76,;3.07,7.22,;1.53,5.68,;2.86,4.91,;4.19,5.68,;2.86,3.37,;4.19,2.6,;4.19,1.06,;2.86,.29,;1.53,1.06,;1.53,2.6,;.19,3.37,;-1.14,2.6,;-1.14,1.06,;-2.48,.29,;-3.81,1.06,;-5.27,.58,;-6.18,1.83,;-5.27,3.07,;-3.81,2.6,;-2.48,3.37,;2.86,-1.25,;4.19,-2.02,;4.19,-3.56,;2.86,-4.33,;2.86,-5.87,;4.19,-6.64,;4.19,-8.18,;5.53,-8.95,;6.86,-8.18,;7.68,-9.49,;8.4,-8.24,;6.86,-6.64,;5.53,-5.87,;2.86,-8.95,;2.86,-10.49,;1.53,-11.26,;.19,-10.49,;-1.14,-11.26,;.19,-8.95,;1.53,-8.18,;1.53,-3.56,;1.53,-2.02,;-7.71,7.22,;-9.25,7.22,)|
BDBM189603 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(NCC4CN(CCF)CCO4)c(c3)[N+]([O-])=O)c(Oc3cnc4[nH]ccc4c3)c2)=C(C1)c1ccc(Cl)cc1 |c:60|
BDBM189604 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(NCC4CN(CC(F)F)CCO4)c(c3)[N+]([O-])=O)c(Oc3cnc4[nH]ccc4c3)c2)=C(C1)c1ccc(Cl)cc1 |c:61|
BDBM189605 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(OCC4CCN(CC4)C4COC4F)c(c3)[N+]([O-])=O)c(Oc3cnc4[nH]ccc4c3)c2)=C(C1)c1ccc(Cl)cc1 |c:63|
BDBM189654 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(OCC4(C)CCOCC4)c(c3)[N+]([O-])=O)c(Oc3cnc4[nH]ccc4c3)c2)=C(C1)c1ccc(Cl)cc1 |c:58|
BDBM189655 CCOC(=O)N1CCN(CC1)c1ccc(cc1[N+]([O-])=O)S(=O)(=O)NC(=O)c1ccc(cc1Oc1cnc2[nH]ccc2c1)N1CCN(CC2=C(CC(C)(C)CC2)c2ccc(Cl)cc2)CC1 |t:52|
BDBM189656 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(N4CCC(CC4)N4CCOCC4)c(c3)[N+]([O-])=O)c(Oc3cnc4[nH]ccc4c3)c2)=C(C1)c1ccc(Cl)cc1 |c:62|
BDBM189765 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3cnc(NCC4CN(CCO4)C4CC4)c(Cl)c3)c(Oc3cnc4[nH]ccc4c3)c2)=C(C1)c1ccc(Cl)cc1 |c:59|
BDBM189766 CCN(C)C(=O)N1CCOC(CNc2ncc(cc2Cl)S(=O)(=O)NC(=O)c2ccc(cc2Oc2cnc3[nH]ccc3c2)N2CCN(CC3=C(CC(C)(C)CC3)c3ccc(Cl)cc3)CC2)C1 |t:51|
BDBM189692 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(N[C@@H]4CCN(CC#N)C4)c(c3)[N+]([O-])=O)c(Oc3cnc4[nH]ccc4c3)c2)=C(C1)c1ccc(Cl)cc1 |c:58|
BDBM189693 COC1(Cc2ccccc2-c2ccc(Cl)cc2)CCN(CC1)c1ccc(C(=O)NS(=O)(=O)c2cnc(OCC3(F)CCOCC3)c(Cl)c2)c(Oc2cnc3[nH]ccc3c2)c1
BDBM189694 COC1(Cc2ccccc2-c2ccc(Cl)cc2)CCN(CC1)c1ccc(C(=O)NS(=O)(=O)c2ccc(NCC3CCOCC3)c(c2)[N+]([O-])=O)c(Oc2cnc3[nH]ccc3c2)c1
BDBM177800 Cn1ccc2cc(ccc12)N(C(=O)c1cc(-c2cc(Br)ccc2C(=O)N2Cc3ccccc3C[C@H]2CN2CCOCC2)n2CCCCc12)c1ccc(O)cc1
BDBM177801 CN1CCc2cc(ccc12)N(C(=O)c1cc(-c2cc(Br)ccc2C(=O)N2Cc3ccccc3C[C@H]2CN2CCOCC2)n2CCCCc12)c1ccc(O)cc1
BDBM177802 Oc1ccc(cc1)N(C(=O)c1cc(-c2cc(Cl)ccc2C(=O)N2Cc3ccccc3C[C@H]2CN2CCOCC2)n2CCCCc12)c1ccccc1
BDBM177803 Oc1ccc(cc1)N(C(=O)c1cc(-c2cc(Cl)ccc2C(=O)N2Cc3ccccc3C[C@H]2CN2CCOCC2)n2CCCCc12)c1ccc2NCCc2c1
BDBM177864 Cn1ccc2cc(ccc12)N(C(=O)c1cc(-c2cc(Cl)ccc2C(=O)N2Cc3ccccc3C[C@H]2CN2CCOCC2)n2CCOCc12)c1ccc(O)cc1
BDBM177865 CCCCN(C(=O)c1cc(-c2cc3OCOc3cc2C(=O)N2Cc3ccccc3C[C@H]2CN2CCOCC2)n2CCCCc12)c1ccc(O)cc1
BDBM177866 Cc1ccc(cc1F)N(C(=O)c1cc(-c2cc(F)ccc2C(=O)N2Cc3ccccc3C[C@H]2CN2CCOCC2)n2CCCCc12)c1ccc(O)cc1
BDBM177867 Cc1ccc(cc1F)N(C(=O)c1cc(-c2cc3OCOc3cc2C(=O)N2Cc3ccccc3C[C@H]2CN2CCOCC2)n2CCOCc12)c1ccc(O)cc1
BDBM189560 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(NC4CCC(CC4)NC4CC4)c(c3)[N+]([O-])=O)c(Oc3cnc4[nH]ccc4c3)c2)=C(C1)c1ccc(Cl)cc1 |c:61,(4,-9.01,;3.18,-7.71,;4.72,-7.76,;3.18,-6.17,;1.85,-5.4,;.51,-6.17,;-.82,-5.4,;-.82,-3.86,;.51,-3.09,;.51,-1.55,;-.82,-.78,;-2.15,-1.55,;-2.15,-3.09,;-.82,.76,;.51,1.53,;.51,3.07,;-.82,3.84,;-.82,5.38,;-2.15,6.15,;.51,6.15,;.51,7.69,;2.05,7.69,;-1.03,7.69,;.51,9.23,;-.82,10,;-.82,11.54,;.51,12.31,;.51,13.85,;-.82,14.62,;-2.15,13.85,;-3.49,14.62,;-3.49,16.16,;-2.15,16.93,;-.82,16.16,;-4.82,16.93,;-4.82,18.47,;-5.59,19.81,;-4.05,19.81,;1.85,11.54,;1.85,10,;3.18,12.31,;3.18,13.85,;4.52,11.54,;-2.15,3.07,;-3.49,3.84,;-4.82,3.07,;-4.82,1.53,;-6.15,.76,;-7.49,1.53,;-8.95,1.06,;-9.86,2.3,;-8.95,3.55,;-7.49,3.07,;-6.15,3.84,;-2.15,1.53,;.51,-7.71,;1.85,-8.48,;-.82,-8.48,;-.82,-10.02,;-2.15,-10.79,;-3.49,-10.02,;-4.82,-10.79,;-3.49,-8.48,;-2.15,-7.71,)|
BDBM189561 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(NC4CCC(CC4)NC4CCOCC4)c(c3)[N+]([O-])=O)c(Oc3cnc4[nH]ccc4c3)c2)=C(C1)c1ccc(Cl)cc1 |c:64,(6.86,-10.36,;6.04,-9.05,;7.58,-9.1,;6.04,-7.51,;4.71,-6.74,;3.37,-7.51,;2.04,-6.74,;2.04,-5.2,;3.37,-4.43,;3.37,-2.89,;2.04,-2.12,;.7,-2.89,;.7,-4.43,;2.04,-.58,;3.37,.19,;3.37,1.73,;2.04,2.5,;2.04,4.04,;.7,4.81,;3.37,4.81,;3.37,6.35,;4.91,6.35,;1.83,6.35,;3.37,7.89,;2.04,8.66,;2.04,10.2,;3.37,10.97,;3.37,12.51,;2.04,13.28,;.7,12.51,;-.63,13.28,;-.63,14.82,;.7,15.59,;2.04,14.82,;-1.96,15.59,;-1.96,17.13,;-.63,17.9,;-.63,19.44,;-1.96,20.21,;-3.3,19.44,;-3.3,17.9,;4.71,10.2,;4.71,8.66,;6.04,10.97,;6.04,12.51,;7.37,10.2,;.7,1.73,;-.63,2.5,;-1.96,1.73,;-1.96,.19,;-3.3,-.58,;-4.63,.19,;-6.09,-.29,;-7,.96,;-6.09,2.21,;-4.63,1.73,;-3.3,2.5,;.7,.19,;3.37,-9.05,;4.71,-9.82,;2.04,-9.82,;2.04,-11.36,;.7,-12.13,;-.63,-11.36,;-1.96,-12.13,;-.63,-9.82,;.7,-9.05,)|
BDBM189606 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(OCC4CCCN4C4COC4(F)F)c(c3)[N+]([O-])=O)c(Oc3cnc4[nH]ccc4c3)c2)=C(C1)c1ccc(Cl)cc1 |c:63|
BDBM189607 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(NCC4COCCN4C4CCOCC4)c(c3)[N+]([O-])=O)c(Oc3cnc4[nH]ccc4c3)c2)=C(C1)c1ccc(Cl)cc1 |c:64|
BDBM189608 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(NCC4COCCN4C4CCC4)c(c3)[N+]([O-])=O)c(Oc3cnc4[nH]ccc4c3)c2)=C(C1)c1ccc(Cl)cc1 |c:62|
BDBM189722 COCCOc1ncc(cc1Cl)S(=O)(=O)NC(=O)c1ccc(cc1Oc1cnc2[nH]ccc2c1)N1CCN(CC2=C(CC(C)(C)CC2)c2ccc(Cl)cc2)CC1 |t:43|
BDBM189723 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3cnc(OCC4CCOCC4)c(F)c3)c(Oc3cnc4[nH]ccc4c3)c2)=C(C1)c1ccc(Cl)cc1 |c:55|
BDBM189724 COCC(=O)N1CCC(COc2ccc(cc2Cl)S(=O)(=O)NC(=O)c2ccc(cc2Oc2cnc3[nH]ccc3c2)N2CCN(CC3=C(CC(C)(C)CC3)c3ccc(Cl)cc3)CC2)CC1 |t:49|
BDBM189769 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(NC4CCC(CC4)N(CCC#N)C4CC4)c(c3)[N+]([O-])=O)c(Oc3cnc4[nH]ccc4c3)c2)=C(C1)c1ccc(Cl)cc1 |c:65,(11.49,-10.55,;10.67,-9.24,;12.21,-9.29,;10.67,-7.7,;9.34,-6.93,;8,-7.7,;6.67,-6.93,;6.67,-5.39,;8,-4.62,;8,-3.08,;6.67,-2.31,;5.33,-3.08,;5.33,-4.62,;6.67,-.77,;8,,;8,1.54,;6.67,2.31,;6.67,3.85,;5.33,4.62,;8,4.62,;8,6.16,;9.54,6.16,;6.46,6.16,;8,7.7,;6.67,8.47,;6.67,10.01,;8,10.78,;8,12.32,;6.67,13.09,;5.33,12.32,;4,13.09,;4,14.63,;5.33,15.4,;6.67,14.63,;2.67,15.4,;2.67,16.94,;1.33,17.71,;1.33,19.25,;1.33,20.79,;1.33,14.63,;.56,13.3,;-.21,14.63,;9.34,10.01,;9.34,8.47,;10.67,10.78,;10.67,12.32,;12,10.01,;5.33,1.54,;4,2.31,;2.67,1.54,;2.67,,;1.33,-.77,;;-1.46,-.48,;-2.37,.77,;-1.46,2.02,;,1.54,;1.33,2.31,;5.33,,;8,-9.24,;9.34,-10.01,;6.67,-10.01,;6.67,-11.55,;5.33,-12.32,;4,-11.55,;2.67,-12.32,;4,-10.01,;5.33,-9.24,)|
BDBM189695 [O-][N+](=O)c1cc(ccc1NCC1CCOCC1)S(=O)(=O)NC(=O)c1ccc(cc1Oc1cnc2[nH]ccc2c1)N1CCN(CC2=C(CCC3(CCN(CC3)C(CF)CF)C2)c2ccc(Cl)cc2)CC1 |t:49|
BDBM189696 CC(C)N1CCC2(CC1)CCC(=C(CN1CCN(CC1)c1ccc(C(=O)NS(=O)(=O)c3ccc(NCC4CCOCC4)c(c3)[N+]([O-])=O)c(Oc3cnc4[nH]ccc4c3)c1)C2)c1ccc(Cl)cc1 |t:12|
BDBM189697 FCC(CF)N1CCC2(CC1)CCC(=C(CN1CCN(CC1)c1ccc(C(=O)NS(=O)(=O)c3cnc(OCC4CCOCC4)c(Cl)c3)c(Oc3cnc4[nH]ccc4c3)c1)C2)c1ccc(Cl)cc1 |t:14|
BDBM177804 Cn1ccc2cc(ccc12)N(C(=O)c1cc(-c2cc(Cl)ccc2C(=O)N2Cc3ccccc3C[C@H]2CN2CCOCC2)n2CCCCc12)c1ccc(O)cc1
BDBM177805 CN1CCc2cc(ccc12)N(C(=O)c1cc(-c2cc(Cl)ccc2C(=O)N2Cc3ccccc3C[C@H]2CN2CCOCC2)n2CCCCc12)c1ccc(O)cc1
BDBM177806 Cn1ccc2cc(ccc12)N(C(=O)c1cc(-c2cc(F)ccc2C(=O)N2Cc3ccccc3C[C@H]2CN2CCOCC2)n2CCCCc12)c1ccc(O)cc1
BDBM177807 Oc1ccc(cc1)N(C(=O)c1cc(-c2cc(F)ccc2C(=O)N2Cc3ccccc3C[C@H]2CN2CCOCC2)n2CCCCc12)c1ccccc1
BDBM177869 Cc1ccc(C(=O)N2Cc3ccccc3C[C@H]2CN2CCOCC2)c(c1)-c1cc(C(=O)N(c2ccc(O)cc2)c2ccc3n(C)ccc3c2)c2CCCCn12
BDBM177870 Cn1ccc2cc(ccc12)N(C(=O)c1cc(-c2cc3OCOc3cc2C(=O)N2Cc3ccccc3C[C@H]2CN2CCOCC2)n2CCCc12)c1ccc(O)cc1
BDBM177871 Cc1ccc(cc1Cl)N(C(=O)c1cc(-c2cc(Cl)ccc2C(=O)N2Cc3ccccc3C[C@H]2CN2CCOCC2)n2CCCCc12)c1ccc(O)cc1
BDBM189562 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3cnc(OC4CCC(CC4)N4CCOCC4)c(Br)c3)c(Oc3cnc4[nH]ccc4c3)c2)=C(C1)c1ccc(Cl)cc1 |c:61,(-2.11,-7.09,;-1.29,-5.78,;-2.83,-5.83,;-1.29,-4.24,;.04,-3.47,;1.37,-4.24,;2.71,-3.47,;2.71,-1.93,;4.04,-1.16,;4.04,.38,;2.71,1.15,;1.37,.38,;1.37,-1.16,;2.71,2.69,;4.04,3.46,;4.04,5,;2.71,5.77,;2.71,7.31,;1.37,8.08,;4.04,8.08,;5.38,7.31,;6.15,8.64,;4.61,5.98,;6.71,6.54,;6.71,5,;8.04,4.23,;9.38,5,;10.71,4.23,;10.71,2.69,;12.04,1.92,;12.04,.38,;10.71,-.39,;9.38,.38,;9.38,1.92,;10.71,-1.93,;12.04,-2.7,;12.04,-4.24,;10.71,-5.01,;9.38,-4.24,;9.38,-2.7,;9.38,6.54,;10.71,7.31,;8.04,7.31,;1.37,5,;.04,5.77,;-1.29,5,;-1.29,3.46,;-2.63,2.69,;-3.96,3.46,;-5.43,2.98,;-6.33,4.23,;-5.43,5.48,;-3.96,5,;-2.63,5.77,;1.37,3.46,;1.37,-5.78,;.04,-6.55,;2.71,-6.55,;4.04,-5.78,;5.38,-6.55,;5.38,-8.09,;6.71,-8.86,;4.04,-8.86,;2.71,-8.09,)|
BDBM189563 COC1CCC(COc2ccc(cc2[N+]([O-])=O)S(=O)(=O)NC(=O)c2ccc(cc2Oc2cnc3[nH]ccc3c2)N2CCN(CC3=C(CC(C)(C)CC3)c3ccc(Cl)cc3)CC2)CC1 |t:48,(-11.38,3.51,;-10.61,2.18,;-9.07,2.18,;-8.3,.84,;-6.76,.84,;-5.99,2.18,;-4.45,2.18,;-3.68,3.51,;-2.14,3.51,;-1.37,2.18,;.17,2.18,;.94,3.51,;.17,4.84,;-1.37,4.84,;-2.14,6.18,;-1.37,7.51,;-3.68,6.18,;2.48,3.51,;2.48,5.05,;4.02,3.51,;2.48,1.97,;3.81,1.2,;5.15,1.97,;3.81,-.34,;5.15,-1.11,;5.15,-2.65,;3.81,-3.42,;2.48,-2.65,;2.48,-1.11,;1.15,-.34,;-.19,-1.11,;-.19,-2.65,;-1.52,-3.42,;-2.85,-2.65,;-4.32,-3.12,;-5.22,-1.88,;-4.32,-.63,;-2.85,-1.11,;-1.52,-.34,;3.81,-4.96,;5.15,-5.73,;5.15,-7.27,;3.81,-8.04,;3.81,-9.58,;5.15,-10.35,;5.15,-11.89,;6.48,-12.66,;7.81,-11.89,;8.63,-13.19,;9.35,-11.94,;7.81,-10.35,;6.48,-9.58,;3.81,-12.66,;3.81,-14.2,;2.48,-14.97,;1.15,-14.2,;-.19,-14.97,;1.15,-12.66,;2.48,-11.89,;2.48,-7.27,;2.48,-5.73,;-6.76,3.51,;-8.3,3.51,)|
BDBM189609 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(NCC4COCCN4C4CCOC4)c(c3)[N+]([O-])=O)c(Oc3cnc4[nH]ccc4c3)c2)=C(C1)c1ccc(Cl)cc1 |c:63|
BDBM189610 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(NCC4CCN(CC4)C(CF)CF)c(c3)[N+]([O-])=O)c(Oc3cnc4[nH]ccc4c3)c2)=C(C1)c1ccc(Cl)cc1 |c:62|
BDBM189611 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(OCC4(F)CCN(CC4)C4CC4)c(c3)[N+]([O-])=O)c(Oc3cnc4[nH]ccc4c3)c2)=C(C1)c1ccc(Cl)cc1 |c:62|
BDBM189725 CN(C)CC(=O)N1CCC(COc2ccc(cc2Cl)S(=O)(=O)NC(=O)c2ccc(cc2Oc2cnc3[nH]ccc3c2)N2CCN(CC3=C(CC(C)(C)CC3)c3ccc(Cl)cc3)CC2)CC1 |t:50|
BDBM189726 CC1(C)CCC(CC2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(NCC4CCOCC4)c(c3)[N+]([O-])=O)c(Oc3cnc4[nH]ccc4c3)c2)C(C1)c1ccc(Cl)cc1
BDBM189727 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3cnc(OCC4CCOCC4)c(c3)C(F)(F)F)c(Oc3cnc4[nH]ccc4c3)c2)=C(C1)c1ccc(Cl)cc1 |c:58|
BDBM189770 CC1(O)CCC(COc2ncc(cc2Cl)S(=O)(=O)NC(=O)c2ccc(cc2Oc2cnc3[nH]ccc3c2)N2CCN(CC3=C(CC4(CC4)CC3)c3ccc(Cl)cc3)CC2)CC1 |t:46,(2.84,-15.44,;4.2,-14.72,;2.84,-14,;4.97,-16.05,;6.51,-16.05,;7.28,-14.72,;8.82,-14.72,;9.59,-13.39,;11.13,-13.39,;11.9,-12.05,;13.44,-12.05,;14.21,-13.39,;13.44,-14.72,;11.9,-14.72,;11.13,-16.05,;15.75,-13.39,;15.75,-14.93,;15.75,-11.85,;17.29,-13.39,;18.06,-12.05,;19.6,-12.05,;17.29,-10.72,;15.75,-10.72,;14.98,-9.39,;15.75,-8.05,;17.29,-8.05,;18.06,-9.39,;19.6,-9.39,;20.37,-8.05,;19.6,-6.72,;20.37,-5.38,;21.91,-5.38,;22.94,-4.24,;24.34,-4.87,;24.18,-6.4,;22.68,-6.72,;21.91,-8.05,;14.98,-6.72,;13.44,-6.72,;12.67,-5.38,;13.44,-4.05,;12.67,-2.72,;11.13,-2.72,;10.36,-1.38,;8.82,-1.38,;8.05,-2.72,;6.71,-3.49,;6.71,-1.95,;8.82,-4.05,;10.36,-4.05,;11.13,-.05,;10.36,1.28,;11.13,2.62,;12.67,2.62,;13.44,3.95,;13.44,1.28,;12.67,-.05,;14.98,-4.05,;15.75,-5.38,;6.51,-13.39,;4.97,-13.39,)|
BDBM189771 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3cnc(OCC4CCc5nccn5C4)c(Cl)c3)c(Oc3cnc4[nH]ccc4c3)c2)=C(C1)c1ccc(Cl)cc1 |c:59|
BDBM50086687 Cc1cc(OCCCc2c(C(O)=O)n3CCSc4cccc2c34)ccc1Cl
BDBM50086691 Cc1cc(OCCCc2c(C(O)=O)n3CCCSc4cccc2c34)cc(C)c1Cl
BDBM50086692 Cc1cc(OCCCc2c(C(O)=O)n3CCCc4c(Cl)ccc2c34)cc(C)c1Cl
BDBM189698 CC(C)N1CCC2(CC1)CCC(=C(CN1CCN(CC1)c1ccc(C(=O)NS(=O)(=O)c3cnc(OCC4CCOCC4)c(Cl)c3)c(Oc3cnc4[nH]ccc4c3)c1)C2)c1ccc(Cl)cc1 |t:12|
BDBM189699 CN1CCC(F)(COc2ncc(cc2Cl)S(=O)(=O)NC(=O)c2ccc(cc2Oc2cnc3[nH]ccc3c2)N2CCN(CC3=C(CC(C)(C)CC3)c3ccc(Cl)cc3)CC2)CC1 |t:46|
BDBM189700 CN(C)CC(=O)N1CCC(F)(COc2ncc(cc2Cl)S(=O)(=O)NC(=O)c2ccc(cc2Oc2cnc3[nH]ccc3c2)N2CCN(CC3=C(CC(C)(C)CC3)c3ccc(Cl)cc3)CC2)CC1 |t:51|
BDBM177808 CN1CCCc2cc(ccc12)N(C(=O)c1cc(-c2cc(Cl)ccc2C(=O)N2Cc3ccccc3C[C@H]2CN2CCOCC2)n2CCCCc12)c1ccc(O)cc1
BDBM177809 CN1CCOc2cc(ccc12)N(C(=O)c1cc(-c2cc(Cl)ccc2C(=O)N2Cc3ccccc3C[C@H]2CN2CCOCC2)n2CCCCc12)c1ccc(O)cc1
BDBM177810 CCN(CC)c1ccc(cc1)N(C(=O)c1cc(-c2cc(Cl)ccc2C(=O)N2Cc3ccccc3C[C@H]2CN2CCOCC2)n2CCCCc12)c1ccc(O)cc1
BDBM177811 Oc1ccc(cc1)N(C(=O)c1cc(-c2cc(Cl)ccc2C(=O)N2Cc3ccccc3C[C@H]2CN2CCOCC2)n2CCCCc12)c1ccc2CCCc2c1
BDBM177872 Cc1ccc(cc1F)N(C(=O)c1cc(-c2cc(F)ccc2C(=O)N2Cc3ccccc3C[C@H]2CN2CCOCC2)n2CCOCc12)c1ccc(O)cc1
BDBM177873 Oc1ccc(cc1)N(C(=O)c1cc(-c2cc(F)ccc2C(=O)N2Cc3ccccc3C[C@H]2CN2CCOCC2)n2CCOCc12)c1ccc(F)cc1
BDBM177874 OC1CCn2c(C1)c(cc2-c1cc(F)ccc1C(=O)N1Cc2ccccc2C[C@H]1CN1CCOCC1)C(=O)N(c1ccccc1)c1ccc(O)cc1
BDBM177875 Cn1ncc2cc(ccc12)N(C(=O)c1cc(-c2cc(Cl)ccc2C(=O)N2Cc3ccccc3C[C@H]2CN2CCOCC2)n2CCOCc12)c1ccc(O)cc1
BDBM189564 CC(C)(C)OC(=O)N1CCC(F)(COc2ccc(cc2[N+]([O-])=O)S(=O)(=O)NC(=O)c2ccc(cc2Oc2cnc3[nH]ccc3c2)N2CCN(CC3=C(CC(C)(C)CC3)c3ccc(Cl)cc3)CC2)CC1 |t:54|
BDBM189565 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(OCC4(F)CCNCC4)c(c3)[N+]([O-])=O)c(Oc3cnc4[nH]ccc4c3)c2)=C(C1)c1ccc(Cl)cc1 |c:58|
BDBM189566 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(NC4CCC(CC4)N4CCN(CC4)C4CCOCC4)c(c3)[N+]([O-])=O)c(Oc3cnc4[nH]ccc4c3)c2)=C(C1)c1ccc(Cl)cc1 |c:70,(3.64,-9.31,;2.82,-8,;4.36,-8.06,;2.82,-6.46,;1.49,-5.69,;.16,-6.46,;-1.18,-5.69,;-1.18,-4.15,;.16,-3.38,;.16,-1.84,;-1.18,-1.07,;-2.51,-1.84,;-2.51,-3.38,;-1.18,.47,;.16,1.24,;.16,2.78,;-1.18,3.55,;-1.18,5.09,;-2.51,5.86,;.16,5.86,;.16,7.4,;1.7,7.4,;-1.38,7.4,;.16,8.94,;-1.18,9.71,;-1.18,11.25,;.16,12.02,;.16,13.56,;-1.18,14.33,;-2.51,13.56,;-3.85,14.33,;-3.85,15.87,;-2.51,16.64,;-1.18,15.87,;-5.18,16.64,;-6.51,15.87,;-7.85,16.64,;-7.85,18.18,;-6.51,18.95,;-5.18,18.18,;-9.18,18.95,;-9.18,20.49,;-10.51,21.26,;-11.85,20.49,;-11.85,18.95,;-10.51,18.18,;1.49,11.25,;1.49,9.71,;2.82,12.02,;4.16,11.25,;2.82,13.56,;-2.51,2.78,;-3.85,3.55,;-5.18,2.78,;-5.18,1.24,;-6.51,.47,;-7.85,1.24,;-9.31,.76,;-10.22,2.01,;-9.31,3.25,;-7.85,2.78,;-6.51,3.55,;-2.51,1.24,;.16,-8,;1.49,-8.77,;-1.18,-8.77,;-1.18,-10.31,;-2.51,-11.08,;-3.85,-10.31,;-5.18,-11.08,;-3.85,-8.77,;-2.51,-8,)|
BDBM189612 COc1ccc(CNc2ccc(cc2[N+]([O-])=O)S(=O)(=O)NC(=O)c2ccc(cc2Oc2cnc3[nH]ccc3c2)N2CCN(CC3=C(CC(C)(C)CC3)c3ccc(Cl)cc3)CC2)cc1 |t:48|
BDBM189613 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(NCc4cccc(OC(F)(F)F)c4)c(c3)[N+]([O-])=O)c(Oc3cnc4[nH]ccc4c3)c2)=C(C1)c1ccc(Cl)cc1 |c:62|
BDBM189614 COc1cccc(CNc2ccc(cc2[N+]([O-])=O)S(=O)(=O)NC(=O)c2ccc(cc2Oc2cnc3[nH]ccc3c2)N2CCN(CC3=C(CC(C)(C)CC3)c3ccc(Cl)cc3)CC2)c1 |t:49|
BDBM189728 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3cnc(OC[C@H]4CC[C@H](O)CC4)c(Cl)c3)c(Oc3cnc4[nH]ccc4c3)c2)=C(C1)c1ccc(Cl)cc1 |wU:29.29,wD:32.33,c:56,(6.65,-10.99,;5.83,-9.69,;7.37,-9.74,;5.83,-8.15,;4.5,-7.38,;3.17,-8.15,;1.83,-7.38,;1.83,-5.84,;3.17,-5.07,;3.17,-3.53,;1.83,-2.76,;.5,-3.53,;.5,-5.07,;1.83,-1.22,;3.17,-.45,;3.17,1.09,;1.83,1.86,;1.83,3.4,;.5,4.17,;3.17,4.17,;4.5,3.4,;5.27,4.74,;3.73,2.07,;5.83,2.63,;5.83,1.09,;7.17,.32,;8.5,1.09,;9.84,.32,;11.17,1.09,;12.5,.32,;13.84,1.09,;15.17,.32,;15.17,-1.22,;16.5,-1.99,;13.84,-1.99,;12.5,-1.22,;8.5,2.63,;9.84,3.4,;7.17,3.4,;.5,1.09,;-.83,1.86,;-2.17,1.09,;-2.17,-.45,;-3.5,-1.22,;-4.83,-.45,;-6.3,-.92,;-7.2,.32,;-6.3,1.57,;-4.83,1.09,;-3.5,1.86,;.5,-.45,;3.17,-9.69,;4.5,-10.46,;1.83,-10.46,;1.83,-12,;.5,-12.77,;-.83,-12,;-2.17,-12.77,;-.83,-10.46,;.5,-9.69,)|
BDBM189729 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(OCC4(F)CCOCC4)c(c3)C#N)c(Oc3cnc4[nH]ccc4c3)c2)=C(C1)c1ccc(Cl)cc1 |c:57|
BDBM189773 FC1(COc2ncc(cc2Cl)S(=O)(=O)NC(=O)c2ccc(cc2Oc2cnc3[nH]ccc3c2)N2CCN(CC3=C(CC4(CC4)CC3)c3ccc(Cl)cc3)CC2)CCN(CC1)C1COC1 |t:42|
BDBM50086693 Cc1cc(OCCCc2c(C(O)=O)n3CCOc4c(Cl)ccc2c34)cc(C)c1Cl
BDBM50086697 OC(=O)c1c(CCCOc2cccc3ccccc23)c2cccc3SCCn1c23
BDBM50086698 OC(=O)c1c(CCCOc2cccc3ccccc23)c2cccc3CCCn1c23
BDBM50086699 OC(=O)c1c(CCCOc2cccc3ccccc23)c2cccc3OCCn1c23
BDBM189701 [O-][N+](=O)c1cc(ccc1NCC1CCOCC1)S(=O)(=O)NC(=O)c1ccc(cc1Oc1cnc2[nH]ccc2c1)N1CCC(F)(Cc2ccccc2-c2ccc(Cl)cc2)CC1
BDBM189702 FC1(COc2ncc(cc2Cl)S(=O)(=O)NC(=O)c2ccc(cc2Oc2cnc3[nH]ccc3c2)N2CCC(F)(Cc3ccccc3-c3ccc(Cl)cc3)CC2)CCOCC1
BDBM189703 CC(C)N1CCC2(CC1)CCC(=C(CN1CCN(CC1)c1ccc(C(=O)NS(=O)(=O)c3ccc(NCC4CCOCC4)c(c3)C(F)(F)F)c(Oc3cnc4[nH]ccc4c3)c1)C2)c1ccc(Cl)cc1 |t:12|
BDBM177812 CN1CCN(C[C@@H]2Cc3ccccc3CN2C(=O)c2ccc(Cl)cc2-c2cc(C(=O)N(c3ccc(O)cc3)c3ccc4n(C)ccc4c3)c3CCCCn23)CC1
BDBM177813 Oc1ccc(cc1)N(C(=O)c1cc(-c2cc3OCCCOc3cc2C(=O)N2Cc3ccccc3C[C@H]2CN2CCOCC2)n2CCCCc12)c1ccccc1
BDBM177814 Cn1ccc2cc(ccc12)N(C(=O)c1cc(-c2cc3OCCCOc3cc2C(=O)N2Cc3ccccc3C[C@H]2CN2CCOCC2)n2CCCCc12)c1ccc(O)cc1
BDBM177815 COc1ccc(C(=O)N2Cc3ccccc3C[C@H]2CN2CCOCC2)c(c1)-c1cc(C(=O)N(c2ccc(O)cc2)c2ccc3n(C)ccc3c2)c2CCCCn12
BDBM177876 Cn1ccc2cc(cnc12)N(C(=O)c1cc(-c2cc(Cl)ccc2C(=O)N2Cc3ccccc3C[C@H]2CN2CCOCC2)n2CCCCc12)c1ccc(O)cc1
BDBM177877 COc1ccc(C(=O)N2Cc3ccccc3C[C@H]2CN2CCOCC2)c(c1)-c1cc(C(=O)N(c2ccc(O)cc2)c2ccc3n(C)ncc3c2)c2CCCCn12
BDBM177878 COCCN1CCN(C[C@@H]2Cc3ccccc3CN2C(=O)c2cc3OCOc3cc2-c2cc(C(=O)N(c3ccccc3)c3ccc(O)cc3)c3CCCCn23)CC1
BDBM177879 CN1CCN(C[C@@H]2Cc3ccccc3CN2C(=O)c2ccc(Cl)cc2-c2cc(C(=O)N(c3ccc(O)cc3)c3ccc4n(C)ccc4c3)c3CCCCn23)CC1=O
BDBM189567 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(OCC4CCN(CC4)C(CF)CF)c(c3)[N+]([O-])=O)c(Oc3cnc4[nH]ccc4c3)c2)=C(C1)c1ccc(Cl)cc1 |c:62|
BDBM189568 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(N[C@@H]4CCN(C4)C4CCOCC4)c(c3)[N+]([O-])=O)c(Oc3cnc4[nH]ccc4c3)c2)=C(C1)c1ccc(Cl)cc1 |c:62|
BDBM189569 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(N[C@@H]4CCN(C4)C4CCOC(C)(C)C4)c(c3)[N+]([O-])=O)c(Oc3cnc4[nH]ccc4c3)c2)=C(C1)c1ccc(Cl)cc1 |c:64|
BDBM189615 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(NCc4ccc(OC(F)F)cc4)c(c3)[N+]([O-])=O)c(Oc3cnc4[nH]ccc4c3)c2)=C(C1)c1ccc(Cl)cc1 |c:61|
BDBM189616 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(NC4CCC5(CC4)OCCO5)c(c3)[N+]([O-])=O)c(Oc3cnc4[nH]ccc4c3)c2)=C(C1)c1ccc(Cl)cc1 |c:61|
BDBM189617 CC(=O)NC1CCC(CC1)Nc1ccc(cc1[N+]([O-])=O)S(=O)(=O)NC(=O)c1ccc(cc1Oc1cnc2[nH]ccc2c1)N1CCN(CC2=C(CC(C)(C)CC2)c2ccc(Cl)cc2)CC1 |t:52,(-5.67,9.52,;-5.67,11.06,;-7,11.83,;-4.34,11.83,;-3,11.06,;-3,9.52,;-1.67,8.75,;-.33,9.52,;-.33,11.06,;-1.67,11.83,;1,8.75,;1,7.21,;-.33,6.44,;-.33,4.9,;1,4.13,;2.33,4.9,;2.33,6.44,;3.67,7.21,;5,6.44,;3.67,8.75,;1,2.59,;-.54,2.59,;2.54,2.59,;1,1.05,;2.33,.28,;3.67,1.05,;2.33,-1.26,;3.67,-2.03,;3.67,-3.57,;2.33,-4.34,;1,-3.57,;1,-2.03,;-.33,-1.26,;-1.67,-2.03,;-1.67,-3.57,;-3,-4.34,;-4.34,-3.57,;-5.8,-4.04,;-6.71,-2.8,;-5.8,-1.55,;-4.34,-2.03,;-3,-1.26,;2.33,-5.88,;3.67,-6.65,;3.67,-8.19,;2.33,-8.96,;2.33,-10.5,;1,-11.27,;1,-12.81,;-.33,-13.58,;-1.67,-12.81,;-2.48,-14.11,;-3.21,-12.86,;-1.67,-11.27,;-.33,-10.5,;2.33,-13.58,;3.67,-12.81,;5,-13.58,;5,-15.12,;6.33,-15.89,;3.67,-15.89,;2.33,-15.12,;1,-8.19,;1,-6.65,)|
BDBM189633 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(OCC4CCC(O)CC4)c(c3)[N+]([O-])=O)c(Oc3cnc4[nH]ccc4c3)c2)=C(C1)c1ccc(Cl)cc1 |c:58,(8.38,-12.87,;7.57,-11.56,;9.11,-11.61,;7.57,-10.02,;6.23,-9.25,;4.9,-10.02,;3.57,-9.25,;3.57,-7.71,;4.9,-6.94,;4.9,-5.4,;3.57,-4.63,;2.23,-5.4,;2.23,-6.94,;3.57,-3.09,;4.9,-2.32,;4.9,-.78,;3.57,-.01,;3.57,1.53,;4.9,2.3,;2.23,2.3,;2.23,3.84,;2.23,5.38,;3.77,3.84,;.69,3.84,;-.08,2.51,;-1.62,2.51,;-2.39,3.84,;-3.93,3.84,;-4.7,2.51,;-6.24,2.51,;-7.01,1.17,;-8.55,1.17,;-9.32,2.51,;-10.86,2.51,;-8.55,3.84,;-7.01,3.84,;-1.62,5.17,;-.08,5.17,;-2.39,6.51,;-1.62,7.84,;-3.93,6.51,;2.23,-.78,;.9,-.01,;-.44,-.78,;-.44,-2.32,;-1.77,-3.09,;-3.1,-2.32,;-4.57,-2.79,;-5.47,-1.55,;-4.57,-.3,;-3.1,-.78,;-1.77,-.01,;2.23,-2.32,;4.9,-11.56,;6.23,-12.33,;3.57,-12.33,;3.57,-13.87,;2.23,-14.64,;.9,-13.87,;-.44,-14.64,;.9,-12.33,;2.23,-11.56,)|
BDBM189730 CO[C@H]1CC[C@H](COc2ncc(cc2C(F)(F)F)S(=O)(=O)NC(=O)c2ccc(cc2Oc2cnc3[nH]ccc3c2)N2CCN(CC3=C(CC(C)(C)CC3)c3ccc(Cl)cc3)CC2)CC1 |wU:5.5,wD:2.1,t:49,(-11.74,9.81,;-10.97,8.48,;-9.43,8.48,;-8.66,7.15,;-7.12,7.15,;-6.35,8.48,;-4.81,8.48,;-4.04,7.15,;-2.5,7.15,;-1.73,5.81,;-.19,5.81,;.58,7.15,;-.19,8.48,;-1.73,8.48,;-2.5,9.81,;-3.27,11.15,;-3.84,9.04,;-1.17,10.58,;2.12,7.15,;2.12,8.69,;3.66,7.15,;2.12,5.61,;3.45,4.84,;4.78,5.61,;3.45,3.3,;4.78,2.53,;4.78,.99,;3.45,.22,;2.12,.99,;2.12,2.53,;.78,3.3,;-.55,2.53,;-.55,.99,;-1.89,.22,;-3.22,.99,;-4.68,.51,;-5.59,1.76,;-4.68,3,;-3.22,2.53,;-1.89,3.3,;3.45,-1.32,;4.78,-2.09,;4.78,-3.63,;3.45,-4.4,;3.45,-5.94,;4.78,-6.71,;4.78,-8.25,;6.12,-9.02,;7.45,-8.25,;8.27,-9.56,;8.99,-8.31,;7.45,-6.71,;6.12,-5.94,;3.45,-9.02,;3.45,-10.56,;2.12,-11.33,;.78,-10.56,;-.55,-11.33,;.78,-9.02,;2.12,-8.25,;2.12,-3.63,;2.12,-2.09,;-7.12,9.81,;-8.66,9.81,)|
BDBM189731 CO[C@@H]1CC[C@H](COc2ncc(cc2C(F)(F)F)S(=O)(=O)NC(=O)c2ccc(cc2Oc2cnc3[nH]ccc3c2)N2CCN(CC3=C(CC(C)(C)CC3)c3ccc(Cl)cc3)CC2)CC1 |wU:2.1,5.5,t:49,(-11.74,9.81,;-10.97,8.48,;-9.43,8.48,;-8.66,7.15,;-7.12,7.15,;-6.35,8.48,;-4.81,8.48,;-4.04,7.15,;-2.5,7.15,;-1.73,5.81,;-.19,5.81,;.58,7.15,;-.19,8.48,;-1.73,8.48,;-2.5,9.81,;-3.27,11.15,;-3.84,9.04,;-1.17,10.58,;2.12,7.15,;2.12,8.69,;3.66,7.15,;2.12,5.61,;3.45,4.84,;4.78,5.61,;3.45,3.3,;4.78,2.53,;4.78,.99,;3.45,.22,;2.12,.99,;2.12,2.53,;.78,3.3,;-.55,2.53,;-.55,.99,;-1.89,.22,;-3.22,.99,;-4.68,.51,;-5.59,1.76,;-4.68,3,;-3.22,2.53,;-1.89,3.3,;3.45,-1.32,;4.78,-2.09,;4.78,-3.63,;3.45,-4.4,;3.45,-5.94,;4.78,-6.71,;4.78,-8.25,;6.12,-9.02,;7.45,-8.25,;8.27,-9.56,;8.99,-8.31,;7.45,-6.71,;6.12,-5.94,;3.45,-9.02,;3.45,-10.56,;2.12,-11.33,;.78,-10.56,;-.55,-11.33,;.78,-9.02,;2.12,-8.25,;2.12,-3.63,;2.12,-2.09,;-7.12,9.81,;-8.66,9.81,)|
BDBM189774 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(NC4CCC(CC4)N4CCC(F)(F)C4)c(c3)[N+]([O-])=O)c(Oc3cnc4[nH]ccc4c3)c2)=C(C1)c1ccc(Cl)cc1 |c:64,(11.49,-10.55,;10.67,-9.24,;12.21,-9.29,;10.67,-7.7,;9.34,-6.93,;8,-7.7,;6.67,-6.93,;6.67,-5.39,;8,-4.62,;8,-3.08,;6.67,-2.31,;5.33,-3.08,;5.33,-4.62,;6.67,-.77,;8,,;8,1.54,;6.67,2.31,;6.67,3.85,;5.33,4.62,;8,4.62,;8,6.16,;9.54,6.16,;6.46,6.16,;8,7.7,;6.67,8.47,;6.67,10.01,;8,10.78,;8,12.32,;6.67,13.09,;5.33,12.32,;4,13.09,;4,14.63,;5.33,15.4,;6.67,14.63,;2.67,15.4,;2.51,16.93,;1,17.25,;.23,15.92,;-1.03,15.03,;-1.18,16.53,;1.26,14.77,;9.34,10.01,;9.34,8.47,;10.67,10.78,;10.67,12.32,;12,10.01,;5.33,1.54,;4,2.31,;2.67,1.54,;2.67,,;1.33,-.77,;;-1.46,-.48,;-2.37,.77,;-1.46,2.02,;,1.54,;1.33,2.31,;5.33,,;8,-9.24,;9.34,-10.01,;6.67,-10.01,;6.67,-11.55,;5.33,-12.32,;4,-11.55,;2.67,-12.32,;4,-10.01,;5.33,-9.24,)|
BDBM50086701 OC(=O)c1c(CCCOc2cccc3ccccc23)c2cccc3SCCCn1c23
BDBM50086702 OC(=O)c1c(CCCOc2cccc3ccccc23)c2cccc3[S+]([O-])CCCn1c23
BDBM50086703 OC(=O)c1c(CCCOc2cccc3ccccc23)c2cccc3c2n1CCCS3(=O)=O
BDBM50086704 OC(=O)c1c(CCCOc2cccc3CCCCc23)c2cccc3SCCn1c23
BDBM189669 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(N[C@@H]4CCOC4)c(c3)[N+]([O-])=O)c(Oc3cnc4[nH]ccc4c3)c2)=C(C1)c1ccc(Cl)cc1 |c:55|
BDBM189668 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(NN4CCN(CC4)C4CCOCC4)c(c3)[N+]([O-])=O)c(Oc3cnc4[nH]ccc4c3)c2)=C(C1)c1ccc(Cl)cc1 |c:63|
BDBM189704 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3cnc(O[C@@H]4CCN(C4)C(CF)CF)c(Cl)c3)c(Oc3cnc4[nH]ccc4c3)c2)=C(C1)c1ccc(Cl)cc1 |c:58|
BDBM189705 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(OCCOC4CCOC4)c(c3)[N+]([O-])=O)c(Oc3cnc4[nH]ccc4c3)c2)=C(C1)c1ccc(Cl)cc1 |c:58|
BDBM189706 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(NC[C@H]4CC[C@@H](CC4)C#N)c(c3)[N+]([O-])=O)c(Oc3cnc4[nH]ccc4c3)c2)=C(C1)c1ccc(Cl)cc1 |wU:29.29,wD:32.36,c:59,(8.2,-9.06,;7.39,-7.76,;8.93,-7.81,;7.39,-6.22,;6.05,-5.45,;4.72,-6.22,;3.39,-5.45,;3.39,-3.91,;4.72,-3.14,;4.72,-1.6,;3.39,-.83,;2.05,-1.6,;2.05,-3.14,;3.39,.71,;4.72,1.48,;4.72,3.02,;3.39,3.79,;3.39,5.33,;4.72,6.1,;2.05,6.1,;2.05,7.64,;2.05,9.18,;3.59,7.64,;.51,7.64,;-.26,6.31,;-1.8,6.31,;-2.57,7.64,;-4.11,7.64,;-4.88,6.31,;-6.42,6.31,;-7.19,4.97,;-8.73,4.97,;-9.5,6.31,;-8.73,7.64,;-7.19,7.64,;-11.04,6.31,;-12.58,6.31,;-1.8,8.98,;-.26,8.98,;-2.57,10.31,;-1.8,11.64,;-4.11,10.31,;2.05,3.02,;.72,3.79,;-.61,3.02,;-.61,1.48,;-1.95,.71,;-3.28,1.48,;-4.75,1.01,;-5.65,2.25,;-4.75,3.5,;-3.28,3.02,;-1.95,3.79,;2.05,1.48,;4.72,-7.76,;6.05,-8.53,;3.39,-8.53,;3.39,-10.07,;2.05,-10.84,;.72,-10.07,;-.61,-10.84,;.72,-8.53,;2.05,-7.76,)|
BDBM177816 Oc1ccc(cc1)N(C(=O)c1cc(-c2cc3OCCOc3cc2C(=O)N2Cc3ccccc3C[C@H]2CN2CCOCC2)n2CCCCc12)c1ccccc1
BDBM177817 Cn1ccc2cc(ccc12)N(C(=O)c1cc(-c2cc3OCCOc3cc2C(=O)N2Cc3ccccc3C[C@H]2CN2CCOCC2)n2CCCCc12)c1ccc(O)cc1
BDBM177880 COCCN(C)C[C@@H]1Cc2ccccc2CN1C(=O)c1ccc(Cl)cc1-c1cc(C(=O)N(c2ccc(O)cc2)c2ccc3n(C)ccc3c2)c2CCCCn12
BDBM177881 CCN(CCOC)C[C@@H]1Cc2ccccc2CN1C(=O)c1ccc(Cl)cc1-c1cc(C(=O)N(c2ccc(O)cc2)c2ccc3n(C)ccc3c2)c2CCCCn12
BDBM177882 Oc1ccc(cc1)N(C(=O)c1cc(-c2cc(Cl)ccc2C(=O)N2Cc3ccccc3C[C@H]2CN2CCOCC2)n2CCCCc12)c1ccc(F)cc1
BDBM177883 COc1ccc(C(=O)N2Cc3ccccc3C[C@H]2CN2CCOCC2)c(c1)-c1cc(C(=O)N(c2ccccc2)c2ccc(O)cc2)c2CCCCn12
BDBM189570 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(N[C@H]4CCN(C4)C4CCOCC4)c(c3)[N+]([O-])=O)c(Oc3cnc4[nH]ccc4c3)c2)=C(C1)c1ccc(Cl)cc1 |c:62|
BDBM189571 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(N[C@H]4CCN(C4)C4CCOC(C)(C)C4)c(c3)[N+]([O-])=O)c(Oc3cnc4[nH]ccc4c3)c2)=C(C1)c1ccc(Cl)cc1 |c:64|
BDBM189572 CN1CCOC(CNc2ccc(cc2[N+]([O-])=O)S(=O)(=O)NC(=O)c2ccc(cc2Oc2cnc3[nH]ccc3c2)N2CCN(CC3=C(CC(C)(C)CC3)c3ccc(Cl)cc3)CC2)C1 |t:48|
BDBM189618 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(N[C@@H]4CCN(CC(F)F)C4)c(c3)[N+]([O-])=O)c(Oc3cnc4[nH]ccc4c3)c2)=C(C1)c1ccc(Cl)cc1 |c:59|
BDBM189619 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(N[C@H]4CCN(CCF)C4)c(c3)[N+]([O-])=O)c(Oc3cnc4[nH]ccc4c3)c2)=C(C1)c1ccc(Cl)cc1 |c:58|
BDBM189620 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(N[C@H]4CCN(CC(F)F)C4)c(c3)[N+]([O-])=O)c(Oc3cnc4[nH]ccc4c3)c2)=C(C1)c1ccc(Cl)cc1 |c:59|
BDBM189634 CN(C)CCCOc1ccc(CNc2ccc(cc2[N+]([O-])=O)S(=O)(=O)NC(=O)c2ccc(cc2Oc2cnc3[nH]ccc3c2)N2CCN(CC3=C(CC(C)(C)CC3)c3ccc(Cl)cc3)CC2)cc1 |t:53|
BDBM189477 COC1CCC(CNc2ccc(cc2[N+]([O-])=O)S(=O)(=O)NC(=O)c2ccc(cc2Oc2cnc3[nH]ccc3c2)N2CCN(CC3=C(CC(C)(C)CC3)c3ccc(Cl)cc3)CC2)CC1 |t:48,(-11.38,3.51,;-10.61,2.18,;-9.07,2.18,;-8.3,.84,;-6.76,.84,;-5.99,2.18,;-4.45,2.18,;-3.68,3.51,;-2.14,3.51,;-1.37,2.18,;.17,2.18,;.94,3.51,;.17,4.84,;-1.37,4.84,;-2.14,6.18,;-1.37,7.51,;-3.68,6.18,;2.48,3.51,;2.48,5.05,;4.02,3.51,;2.48,1.97,;3.81,1.2,;5.15,1.97,;3.81,-.34,;5.15,-1.11,;5.15,-2.65,;3.81,-3.42,;2.48,-2.65,;2.48,-1.11,;1.15,-.34,;-.19,-1.11,;-.19,-2.65,;-1.52,-3.42,;-2.85,-2.65,;-4.32,-3.12,;-5.22,-1.88,;-4.32,-.63,;-2.85,-1.11,;-1.52,-.34,;3.81,-4.96,;5.15,-5.73,;5.15,-7.27,;3.81,-8.04,;3.81,-9.58,;5.15,-10.35,;5.15,-11.89,;6.48,-12.66,;7.81,-11.89,;8.63,-13.19,;9.35,-11.94,;7.81,-10.35,;6.48,-9.58,;3.81,-12.66,;3.81,-14.2,;2.48,-14.97,;1.15,-14.2,;-.19,-14.97,;1.15,-12.66,;2.48,-11.89,;2.48,-7.27,;2.48,-5.73,;-6.76,3.51,;-8.3,3.51,)|
BDBM189732 CC1(C)CCC(CC2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3cnc(OCC4(O)CCC(F)(F)CC4)c(Cl)c3)c(Oc3cnc4[nH]ccc4c3)c2)=C(C1)c1ccc(Cl)cc1 |c:58|
BDBM189733 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(OC[C@H]4CC[C@@H](CC4)N4CCOCC4)c(Cl)c3)c(Oc3cnc4[nH]ccc4c3)c2)=C(C1)c1ccc(Cl)cc1 |wU:29.29,wD:32.36,c:62,(12.7,-12.49,;11.88,-11.18,;13.42,-11.23,;11.88,-9.64,;10.55,-8.87,;9.21,-9.64,;7.88,-8.87,;7.88,-7.33,;9.21,-6.56,;9.21,-5.02,;7.88,-4.25,;6.55,-5.02,;6.55,-6.56,;7.88,-2.71,;9.21,-1.94,;9.21,-.4,;7.88,.37,;7.88,1.91,;9.21,2.68,;6.55,2.68,;6.55,4.22,;8.09,4.22,;6.55,5.76,;5.01,4.22,;4.24,5.55,;2.7,5.55,;1.93,4.22,;.39,4.22,;-.38,2.89,;-1.92,2.89,;-2.69,1.55,;-4.23,1.55,;-5,2.89,;-4.23,4.22,;-2.69,4.22,;-6.54,2.89,;-7.31,1.55,;-8.85,1.55,;-9.62,2.89,;-8.85,4.22,;-7.31,4.22,;2.7,2.89,;1.93,1.55,;4.24,2.89,;6.55,-.4,;5.21,.37,;3.88,-.4,;3.88,-1.94,;2.54,-2.71,;1.21,-1.94,;-.25,-2.42,;-1.16,-1.17,;-.25,.08,;1.21,-.4,;2.54,.37,;6.55,-1.94,;9.21,-11.18,;10.55,-11.95,;7.88,-11.95,;7.88,-13.49,;6.55,-14.26,;5.21,-13.49,;3.88,-14.26,;5.21,-11.95,;6.55,-11.18,)|
BDBM189777 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(NC4CCC(CC4)NC4CC4(F)F)c(c3)[N+]([O-])=O)c(Oc3cnc4[nH]ccc4c3)c2)=C(C1)c1ccc(Cl)cc1 |c:63,(11.49,-10.55,;10.67,-9.24,;12.21,-9.29,;10.67,-7.7,;9.34,-6.93,;8,-7.7,;6.67,-6.93,;6.67,-5.39,;8,-4.62,;8,-3.08,;6.67,-2.31,;5.33,-3.08,;5.33,-4.62,;6.67,-.77,;8,,;8,1.54,;6.67,2.31,;6.67,3.85,;5.33,4.62,;8,4.62,;8,6.16,;9.54,6.16,;6.46,6.16,;8,7.7,;6.67,8.47,;6.67,10.01,;8,10.78,;8,12.32,;6.67,13.09,;5.33,12.32,;4,13.09,;4,14.63,;5.33,15.4,;6.67,14.63,;2.67,15.4,;2.67,16.94,;3.44,18.27,;1.9,18.27,;.36,18.14,;1.25,19.67,;9.34,10.01,;9.34,8.47,;10.67,10.78,;10.67,12.32,;12,10.01,;5.33,1.54,;4,2.31,;2.67,1.54,;2.67,,;1.33,-.77,;;-1.46,-.48,;-2.37,.77,;-1.46,2.02,;,1.54,;1.33,2.31,;5.33,,;8,-9.24,;9.34,-10.01,;6.67,-10.01,;6.67,-11.55,;5.33,-12.32,;4,-11.55,;2.67,-12.32,;4,-10.01,;5.33,-9.24,)|
BDBM189793 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(NCC4CCC(C)(CC4)C#N)c(c3)[N+]([O-])=O)c(Oc3cnc4[nH]ccc4c3)c2)=C(C1)c1ccc(Cl)cc1 |c:60,(11.49,-10.55,;10.67,-9.24,;12.21,-9.29,;10.67,-7.7,;9.34,-6.93,;8,-7.7,;6.67,-6.93,;6.67,-5.39,;8,-4.62,;8,-3.08,;6.67,-2.31,;5.33,-3.08,;5.33,-4.62,;6.67,-.77,;8,,;8,1.54,;6.67,2.31,;6.67,3.85,;8,4.62,;5.33,4.62,;5.33,6.16,;5.33,7.7,;6.87,6.16,;3.79,6.16,;3.02,4.83,;1.48,4.83,;.71,6.16,;-.83,6.16,;-1.6,4.83,;-3.14,4.83,;-3.91,3.49,;-5.45,3.49,;-6.22,4.83,;-7.57,4.1,;-5.45,6.16,;-3.91,6.16,;-7.57,5.55,;-8.93,6.27,;1.48,7.49,;3.02,7.49,;.71,8.83,;1.48,10.16,;-.83,8.83,;5.33,1.54,;4,2.31,;2.67,1.54,;2.67,,;1.33,-.77,;;-1.46,-.48,;-2.37,.77,;-1.46,2.02,;,1.54,;1.33,2.31,;5.33,,;8,-9.24,;9.34,-10.01,;6.67,-10.01,;6.67,-11.55,;5.33,-12.32,;4,-11.55,;2.67,-12.32,;4,-10.01,;5.33,-9.24,)|
BDBM189670 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(NCC4CCC(F)(F)CC4)c(c3)[N+]([O-])=O)c(Oc3cnc4[nH]ccc4c3)c2)=C(C1)c1ccc(Cl)cc1 |c:59|
BDBM189671 CC(C)(C)N1CCC(CC1)Nc1ccc(cc1S(=O)(=O)C(F)(F)F)S(=O)(=O)NC(=O)c1ccc(cc1Oc1cnc2[nH]ccc2c1)N1CCN(CC2=C(CC(C)(C)CC2)c2ccc(Cl)cc2)CC1 |t:56|
BDBM189707 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3cnc(OCC4(F)CCN(CC4)C4COC4)c(Cl)c3)c(Oc3cnc4[nH]ccc4c3)c2)=C(C1)c1ccc(Cl)cc1 |c:61|
BDBM189708 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3cnc(OCCC4CCOCC4)c(c3)C#N)c(Oc3cnc4[nH]ccc4c3)c2)=C(C1)c1ccc(Cl)cc1 |c:57|
BDBM189709 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(OCc4ccoc4)c(c3)[N+]([O-])=O)c(Oc3cnc4[nH]ccc4c3)c2)=C(C1)c1ccc(Cl)cc1 |c:56|
BDBM177820 Cn1ncc2cc(ccc12)N(C(=O)c1cc(-c2cc3OCCOc3cc2C(=O)N2Cc3ccccc3C[C@H]2CN2CCOCC2)n2CCCCc12)c1ccc(O)cc1
BDBM177821 CN1CCCc2cc(ccc12)N(C(=O)c1cc(-c2cc3OCCOc3cc2C(=O)N2Cc3ccccc3C[C@H]2CN2CCOCC2)n2CCCCc12)c1ccc(O)cc1
BDBM177822 CN1CCOc2cc(ccc12)N(C(=O)c1cc(-c2cc3OCCOc3cc2C(=O)N2Cc3ccccc3C[C@H]2CN2CCOCC2)n2CCCCc12)c1ccc(O)cc1
BDBM177823 Cn1ncc2cc(ccc12)N(C(=O)c1cc(-c2cc(Cl)ccc2C(=O)N2Cc3ccccc3C[C@H]2CN2CCOCC2)n2CCCCc12)c1ccc(O)cc1
BDBM177884 OC1CCn2c(C1)c(cc2-c1cc2OCOc2cc1C(=O)N1Cc2ccccc2C[C@H]1CN1CCOCC1)C(=O)N(c1ccccc1)c1ccc(O)cc1
BDBM177885 COc1ccc(C(=O)N2Cc3ccccc3C[C@H]2CN2CCOCC2)c(c1)-c1cc(C(=O)N(c2ccc(O)cc2)c2ccc(C)c(F)c2)c2CCCCn12
BDBM177886 Oc1ccc(cc1)N(C(=O)c1cc(-c2cc(Cl)ccc2C(=O)N2Cc3ccccc3C[C@H]2CN2CCOCC2)n2CCCCc12)c1ccccc1F
BDBM177887 Oc1ccc(cc1)N(C(=O)c1cc(-c2cc(Cl)ccc2C(=O)N2Cc3ccccc3C[C@H]2CN2CCOCC2)n2CCCCc12)c1cccc(F)c1
BDBM60602 CN1[C@H]2CC[C@@H]1CC(C2)Nc1ccc(cc1[N+]([O-])=O)S(=O)(=O)NC(=O)c1ccc(cc1Oc1ccc2[nH]ccc2c1)N1CCN(CC2=C(CC(C)(C)CC2)c2ccc(Cl)cc2)CC1 |r,t:52,TLB:9:7:3.4:1|
BDBM189573 COCCN1CCOC(CNc2ccc(cc2[N+]([O-])=O)S(=O)(=O)NC(=O)c2ccc(cc2Oc2cnc3[nH]ccc3c2)N2CCN(CC3=C(CC(C)(C)CC3)c3ccc(Cl)cc3)CC2)C1 |t:51|
BDBM189574 CC(=O)N1CCOC(CNc2ccc(cc2[N+]([O-])=O)S(=O)(=O)NC(=O)c2ccc(cc2Oc2cnc3[nH]ccc3c2)N2CCN(CC3=C(CC(C)(C)CC3)c3ccc(Cl)cc3)CC2)C1 |t:50|
BDBM189575 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(OCC4CCN(C4)[C@@H]4CO[C@H]4CF)c(c3)[N+]([O-])=O)c(Oc3cnc4[nH]ccc4c3)c2)=C(C1)c1ccc(Cl)cc1 |c:63|
BDBM189621 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(OCC4CCN(C4)C4COC4)c(c3)[N+]([O-])=O)c(Oc3cnc4[nH]ccc4c3)c2)=C(C1)c1ccc(Cl)cc1 |c:61|
BDBM189622 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(NCc4ccc(O)cc4)c(c3)[N+]([O-])=O)c(Oc3cnc4[nH]ccc4c3)c2)=C(C1)c1ccc(Cl)cc1 |c:58|
BDBM189623 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(NCc4cccc(O)c4)c(c3)[N+]([O-])=O)c(Oc3cnc4[nH]ccc4c3)c2)=C(C1)c1ccc(Cl)cc1 |c:58|
BDBM177838 CN1CCN(C[C@@H]2Cc3ccccc3CN2C(=O)c2ccc3OCOc3c2-c2cc(C(=O)N(c3ccc(O)cc3)c3ccc4n(C)ccc4c3)c3ccccn23)CC1 |wU:6.5,(9.68,5.43,;10.45,6.76,;11.98,6.6,;12.89,7.84,;12.26,9.25,;13.17,10.5,;14.7,10.34,;15.32,8.93,;16.86,8.77,;17.48,7.36,;19.01,7.2,;19.92,8.45,;19.29,9.85,;17.76,10.01,;17.14,11.42,;15.6,11.58,;14.98,12.99,;13.45,13.15,;15.88,14.24,;17.41,14.07,;18.32,15.32,;17.69,16.73,;18.46,18.06,;17.1,19.15,;15.76,18.38,;16.16,16.89,;15.26,15.64,;13.72,15.8,;12.69,14.66,;11.29,15.28,;9.95,14.51,;9.95,12.97,;8.62,15.28,;8.62,16.82,;7.29,17.59,;7.29,19.13,;8.62,19.9,;8.62,21.44,;9.95,19.13,;9.95,17.59,;7.29,14.51,;7.29,12.97,;5.95,12.2,;4.62,12.97,;3.15,12.5,;2.68,11.03,;2.25,13.74,;3.15,14.99,;4.62,14.51,;5.95,15.28,;11.45,16.82,;10.42,17.96,;10.89,19.43,;12.4,19.75,;13.43,18.6,;12.95,17.14,;10.73,9.41,;9.83,8.17,)|
BDBM189735 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(OC[C@H]4CC[C@H](O)CC4)c(Cl)c3)c(Oc3cnc4[nH]ccc4c3)c2)=C(C1)c1ccc(Cl)cc1 |wU:29.29,wD:32.33,c:56,(11.4,-12.25,;10.59,-10.94,;12.13,-10.99,;10.59,-9.4,;9.25,-8.63,;7.92,-9.4,;6.59,-8.63,;6.59,-7.09,;7.92,-6.32,;7.92,-4.78,;6.59,-4.01,;5.25,-4.78,;5.25,-6.32,;6.59,-2.47,;7.92,-1.7,;7.92,-.16,;6.59,.61,;6.59,2.15,;7.92,2.92,;5.25,2.92,;5.25,4.46,;6.79,4.46,;5.25,6,;3.71,4.46,;2.94,5.79,;1.4,5.79,;.63,4.46,;-.91,4.46,;-1.68,3.13,;-3.22,3.13,;-3.99,1.79,;-5.53,1.79,;-6.3,3.13,;-7.84,3.13,;-5.53,4.46,;-3.99,4.46,;1.4,3.13,;.63,1.79,;2.94,3.13,;5.25,-.16,;3.92,.61,;2.59,-.16,;2.59,-1.7,;1.25,-2.47,;-.08,-1.7,;-1.55,-2.18,;-2.45,-.93,;-1.55,.32,;-.08,-.16,;1.25,.61,;5.25,-1.7,;7.92,-10.94,;9.25,-11.71,;6.59,-11.71,;6.59,-13.25,;5.25,-14.02,;3.92,-13.25,;2.59,-14.02,;3.92,-11.71,;5.25,-10.94,)|
BDBM189736 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(NCC4CCOCC4)c(Cl)c3)c(Oc3cnc4[nH]ccc4c3)c2)=C(C1)c1ccc(Cl)cc1 |c:55|
BDBM189737 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(OCC4(F)CCOCC4)c(c3)C(F)(F)F)c(Oc3cnc4[nH]ccc4c3)c2)=C(C1)c1ccc(Cl)cc1 |c:59|
BDBM189778 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3cnc(OCC4(F)CCC(O)CC4)c(Cl)c3)c(Oc3cnc4[nH]ccc4c3)c2)=C(C1)c1ccc(Cl)cc1 |c:57,(-2.44,-10.6,;-1.63,-9.3,;-3.17,-9.35,;-1.63,-7.76,;-.29,-6.99,;1.04,-7.76,;2.37,-6.99,;2.37,-5.45,;3.71,-4.68,;3.71,-3.14,;2.37,-2.37,;1.04,-3.14,;1.04,-4.68,;2.37,-.83,;3.71,-.06,;3.71,1.48,;2.37,2.25,;2.37,3.79,;1.04,4.56,;3.71,4.56,;5.04,3.79,;5.81,5.13,;4.27,2.46,;6.38,3.02,;6.38,1.48,;7.71,.71,;9.04,1.48,;10.38,.71,;10.38,-.83,;11.71,-1.6,;11.6,-.06,;13.25,-1.54,;14.07,-2.85,;13.34,-4.21,;14.16,-5.51,;11.8,-4.26,;10.99,-2.96,;9.04,3.02,;10.38,3.79,;7.71,3.79,;1.04,1.48,;-.29,2.25,;-1.63,1.48,;-1.63,-.06,;-2.96,-.83,;-4.29,-.06,;-5.76,-.53,;-6.66,.71,;-5.76,1.96,;-4.29,1.48,;-2.96,2.25,;1.04,-.06,;1.04,-9.3,;-.29,-10.07,;2.37,-10.07,;3.71,-9.3,;5.04,-10.07,;5.04,-11.61,;6.38,-12.38,;3.71,-12.38,;2.37,-11.61,)|
BDBM189779 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(OCC4CCC5(COC5)CC4)c(c3)[N+]([O-])=O)c(Oc3cnc4[nH]ccc4c3)c2)=C(C1)c1ccc(Cl)cc1 |c:61|
BDBM189796 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3cnc4n(CC5CCOCC5)nnc4c3)c(Oc3cnc4[nH]ccc4c3)c2)=C(C1)c1ccc(Cl)cc1 |c:57|
BDBM189481 CC1(C)CC(=C(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(NC4CCC(CC4)N4CCOCC4)c(c3)[N+]([O-])=O)c(Oc3cnc4[nH]ccc4c3)c2)CO1)c1ccc(Cl)cc1 |t:4,(8.32,-14.13,;7.51,-12.83,;9.04,-12.88,;6.17,-13.6,;4.84,-12.83,;4.84,-11.29,;3.5,-10.52,;3.5,-8.98,;4.84,-8.21,;4.84,-6.67,;3.5,-5.9,;2.17,-6.67,;2.17,-8.21,;3.5,-4.36,;4.84,-3.59,;4.84,-2.05,;3.5,-1.28,;3.5,.26,;2.17,1.03,;4.84,1.03,;4.84,2.57,;6.38,2.57,;3.3,2.57,;4.84,4.11,;3.5,4.88,;3.5,6.42,;4.84,7.19,;4.84,8.73,;3.5,9.5,;2.17,8.73,;.84,9.5,;.84,11.04,;2.17,11.81,;3.5,11.04,;-.5,11.81,;-1.83,11.04,;-3.16,11.81,;-3.16,13.35,;-1.83,14.12,;-.5,13.35,;6.17,6.42,;6.17,4.88,;7.51,7.19,;7.51,8.73,;8.84,6.42,;2.17,-2.05,;.84,-1.28,;-.5,-2.05,;-.5,-3.59,;-1.83,-4.36,;-3.16,-3.59,;-4.63,-4.06,;-5.53,-2.82,;-4.63,-1.57,;-3.16,-2.05,;-1.83,-1.28,;2.17,-3.59,;6.17,-10.52,;7.51,-11.29,;3.5,-13.6,;3.5,-15.14,;2.17,-15.91,;.84,-15.14,;-.5,-15.91,;.84,-13.6,;2.17,-12.83,)|
BDBM189672 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(NCC4CN(CCO4)C4COC4)c(c3)S(=O)(=O)C(F)(F)F)c(Oc3cnc4[nH]ccc4c3)c2)=C(C1)c1ccc(Cl)cc1 |c:66|
BDBM189673 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3cnc(NCC4(F)CCOCC4)c(Cl)c3)c(Oc3cnc4[nH]ccc4c3)c2)=C(C1)c1ccc(Cl)cc1 |c:56|
BDBM189674 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3cnc(NC4CCN(CC4)C4CC4)c(Cl)c3)c(Oc3cnc4[nH]ccc4c3)c2)=C(C1)c1ccc(Cl)cc1 |c:58|
BDBM189710 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3cnc(OC[C@@H]4CCN(C4)C(CF)CF)c(Cl)c3)c(Oc3cnc4[nH]ccc4c3)c2)=C(C1)c1ccc(Cl)cc1 |c:59|
BDBM189711 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3cnc(OC[C@@H]4CCN(CC(F)F)C4)c(Cl)c3)c(Oc3cnc4[nH]ccc4c3)c2)=C(C1)c1ccc(Cl)cc1 |c:58|
BDBM189712 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3cnc(OCC4(F)CCN(CC4)C(CF)CF)c(Cl)c3)c(Oc3cnc4[nH]ccc4c3)c2)=C(C1)c1ccc(Cl)cc1 |c:61|
BDBM177824 CN1CCc2cc(ccc12)N(C(=O)c1cc(c2CCCCn12)-c1cc(Cl)ccc1C(=O)N1Cc2ccccc2C[C@H]1CN1CCOCC1)c1ccc(O)cc1
BDBM177825 Cn1ncc2cc(ccc12)N(C(=O)c1cc(-c2cc(F)ccc2C(=O)N2Cc3ccccc3C[C@H]2CN2CCOCC2)n2CCCCc12)c1ccc(O)cc1
BDBM177826 CN1CC2(CC2)c2cc(ccc12)N(C(=O)c1cc(-c2cc(Cl)ccc2C(=O)N2Cc3ccccc3C[C@H]2CN2CCOCC2)n2CCCCc12)c1ccc(O)cc1
BDBM177827 Cn1ccc2cc(ccc12)N(C(=O)c1cc(-c2cc(Cl)ccc2C(=O)N2Cc3ccccc3C[C@H]2CN2CCCOCC2)n2CCCCc12)c1ccc(O)cc1
BDBM177888 Oc1ccc(cc1)N(C(=O)c1cc(-c2cc(Cl)ccc2C(=O)N2Cc3ccccc3C[C@H]2CN2CCOCC2)n2CCCCc12)c1ccc(F)cc1F
BDBM177889 Oc1ccc(cc1)N(C(=O)c1cc(-c2cc(Cl)ccc2C(=O)N2Cc3ccccc3C[C@H]2CN2CCOCC2)n2CCCCc12)c1ccc(F)c(F)c1
BDBM177890 Oc1ccc(cc1)N(C(=O)c1cc(-c2cc(Cl)ccc2C(=O)N2Cc3ccccc3C[C@H]2CN2CCOCC2)n2CCCCc12)c1cccc(c1)C#N
BDBM177891 Oc1ccc(cc1)N(C(=O)c1cc(-c2cc3OCOc3cc2C(=O)N2Cc3ccccc3C[C@H]2CN2CCOCC2)n2ccncc12)c1cccc(F)c1
BDBM189576 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(NCC4(F)CCOCC4)c(c3)[N+]([O-])=O)c(Oc3cnc4[nH]ccc4c3)c2)=C(C1)c1ccc(Cl)cc1 |c:58|
BDBM189577 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(NC4CCN(CC4)C4COC4)c(c3)[N+]([O-])=O)c(Oc3cnc4[nH]ccc4c3)c2)=C(C1)c1ccc(Cl)cc1 |c:61|
BDBM189578 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(NC4CCN(CC4)C4CCC4)c(c3)[N+]([O-])=O)c(Oc3cnc4[nH]ccc4c3)c2)=C(C1)c1ccc(Cl)cc1 |c:61|
BDBM189624 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(NCc4cccc(OC(F)F)c4)c(c3)[N+]([O-])=O)c(Oc3cnc4[nH]ccc4c3)c2)=C(C1)c1ccc(Cl)cc1 |c:61|
BDBM189625 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(NC[C@@H]4CC[C@@H](C4)N4CCOCC4)c(c3)[N+]([O-])=O)c(Oc3cnc4[nH]ccc4c3)c2)=C(C1)c1ccc(Cl)cc1 |c:63|
BDBM189626 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(NC4CCC(CC4)NS(C)(=O)=O)c(c3)[N+]([O-])=O)c(Oc3cnc4[nH]ccc4c3)c2)=C(C1)c1ccc(Cl)cc1 |c:61,(5.77,-14.78,;4.95,-13.47,;6.49,-13.53,;4.95,-11.93,;3.62,-11.16,;2.29,-11.93,;.95,-11.16,;.95,-9.62,;2.29,-8.85,;2.29,-7.31,;.95,-6.54,;-.38,-7.31,;-.38,-8.85,;.95,-5,;2.29,-4.23,;2.29,-2.69,;.95,-1.92,;.95,-.38,;-.38,.39,;2.29,.39,;2.29,1.93,;3.83,1.93,;.75,1.93,;2.29,3.47,;.95,4.24,;.95,5.78,;2.29,6.55,;2.29,8.09,;.95,8.86,;-.38,8.09,;-1.72,8.86,;-1.72,10.4,;-.38,11.17,;.95,10.4,;-3.05,11.17,;-3.05,12.71,;-1.51,12.71,;-3.05,14.25,;-4.59,12.71,;3.62,5.78,;3.62,4.24,;4.95,6.55,;4.95,8.09,;6.29,5.78,;-.38,-2.69,;-1.72,-1.92,;-3.05,-2.69,;-3.05,-4.23,;-4.38,-5,;-5.72,-4.23,;-7.18,-4.71,;-8.09,-3.46,;-7.18,-2.22,;-5.72,-2.69,;-4.38,-1.92,;-.38,-4.23,;2.29,-13.47,;3.62,-14.24,;.95,-14.24,;.95,-15.78,;-.38,-16.55,;-1.72,-15.78,;-3.05,-16.55,;-1.72,-14.24,;-.38,-13.47,)|
BDBM189738 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(NCCCN(CC(F)(F)F)C4CC4)c(c3)[N+]([O-])=O)c(Oc3cnc4[nH]ccc4c3)c2)=C(C1)c1ccc(Cl)cc1 |c:62|
BDBM189739 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(OCC4CCN(CC4)C4COC4)c(Cl)c3)c(Oc3cnc4[nH]ccc4c3)c2)=C(C1)c1ccc(Cl)cc1 |c:60|
BDBM189740 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3cc(F)c(OCC4(F)CCOCC4)c(F)c3)c(Oc3cnc4[nH]ccc4c3)c2)=C(C1)c1ccc(Cl)cc1 |c:57|
BDBM189781 [O-][N+](=O)c1cc(ccc1NCC1CCOCC1)S(=O)(=O)NC(=O)c1ccc(cc1Oc1cnc2[nH]ccc2c1)N1CCN(CC2=C(CCC(CF)(CF)C2)c2ccc(Cl)cc2)CC1 |t:49|
BDBM189782 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(OCC4CN(CCO4)C4CC4)c(c3)[N+]([O-])=O)c(Oc3cnc4[nH]ccc4c3)c2)=C(C1)c1ccc(Cl)cc1 |c:61|
BDBM189799 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(NC(=O)N4CCOCC4)c(c3)[N+]([O-])=O)c(Oc3cnc4[nH]ccc4c3)c2)=C(C1)c1ccc(Cl)cc1 |c:58|
BDBM189713 CN1CCC(F)(COc2ccc(cc2Cl)S(=O)(=O)NC(=O)c2ccc(cc2Oc2cnc3[nH]ccc3c2)N2CCN(CC3=C(CC(C)(C)CC3)c3ccc(Cl)cc3)CC2)CC1 |t:46|
BDBM189714 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(OCC4CCOCC4)c(c3)C#N)c(Oc3cnc4[nH]ccc4c3)c2)=C(C1)c1ccc(Cl)cc1 |c:56|
BDBM189715 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3cnc(OCC4(F)CCN(CC(F)F)CC4)c(Cl)c3)c(Oc3cnc4[nH]ccc4c3)c2)=C(C1)c1ccc(Cl)cc1 |c:60|
BDBM177828 Cn1ccc2cc(ccc12)N(C(=O)c1cc(-c2cc(ccc2C(=O)N2Cc3ccccc3C[C@H]2CN2CCOCC2)C(F)(F)F)n2CCCCc12)c1ccc(O)cc1
BDBM177829 Cn1ccc2cc(ccc12)N(C(=O)c1cc(-c2cc(OC(F)(F)F)ccc2C(=O)N2Cc3ccccc3C[C@H]2CN2CCOCC2)n2CCCCc12)c1ccc(O)cc1
BDBM177830 CN1CC(C)(C)c2cc(ccc12)N(C(=O)c1cc(-c2cc(Cl)ccc2C(=O)N2Cc3ccccc3C[C@H]2CN2CCOCC2)n2CCCCc12)c1ccc(O)cc1
BDBM177892 Oc1ccc(cc1)N(C(=O)c1cc(-c2cc3OCOc3cc2C(=O)N2Cc3ccccc3C[C@H]2CN2CCOCC2)n2CCCCc12)c1cccc(F)c1
BDBM177893 CS(=O)(=O)N1CCN(C[C@@H]2Cc3ccccc3CN2C(=O)c2cc3OCOc3cc2-c2cc(C(=O)N(c3ccccc3)c3ccc(O)cc3)c3CCCCn23)CC1
BDBM177894 COc1cccc(c1)N(C(=O)c1cc(-c2cc(Cl)ccc2C(=O)N2Cc3ccccc3C[C@H]2CN2CCOCC2)n2CCCCc12)c1ccc(O)cc1
BDBM177895 Oc1ccc(cc1)N(C(=O)c1cc(-c2cc(Cl)ccc2C(=O)N2Cc3ccccc3C[C@H]2CN2CCOCC2)n2CCCCc12)c1cc(F)cc(F)c1
BDBM189579 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(NC4CCN(CC4)C4CCOC(C)(C)C4)c(c3)[N+]([O-])=O)c(Oc3cnc4[nH]ccc4c3)c2)=C(C1)c1ccc(Cl)cc1 |c:65|
BDBM189580 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(N[C@H]4CCN(C4)C4CC4)c(c3)[N+]([O-])=O)c(Oc3cnc4[nH]ccc4c3)c2)=C(C1)c1ccc(Cl)cc1 |c:59|
BDBM189581 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(NC4CCN(CC4)C4CCOC4)c(c3)[N+]([O-])=O)c(Oc3cnc4[nH]ccc4c3)c2)=C(C1)c1ccc(Cl)cc1 |c:62|
BDBM189627 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(NC4CCN(CC4)C4CC4)c(c3)S(=O)(=O)C(F)(F)F)c(Oc3cnc4[nH]ccc4c3)c2)=C(C1)c1ccc(Cl)cc1 |c:64|
BDBM189628 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(OCC4CCN(CC4)C4COC4)c(c3)[N+]([O-])=O)c(Oc3cnc4[nH]ccc4c3)c2)=C(C1)c1ccc(Cl)cc1 |c:62|
BDBM189629 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(OCC4(F)CCN(CC4)C4CCOCC4)c(c3)[N+]([O-])=O)c(Oc3cnc4[nH]ccc4c3)c2)=C(C1)c1ccc(Cl)cc1 |c:65|
BDBM189741 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(NCCCN(C4CC4)C4COC4)c(c3)[N+]([O-])=O)c(Oc3cnc4[nH]ccc4c3)c2)=C(C1)c1ccc(Cl)cc1 |c:62|
BDBM189742 CN1CCC[C@H]1C(=O)N1CCC(COc2ccc(cc2Cl)S(=O)(=O)NC(=O)c2ccc(cc2Oc2cnc3[nH]ccc3c2)N2CCN(CC3=C(CC(C)(C)CC3)c3ccc(Cl)cc3)CC2)CC1 |t:53|
BDBM189743 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3cc(F)c(F)c(OCC4(F)CCOCC4)c3)c(Oc3cnc4[nH]ccc4c3)c2)=C(C1)c1ccc(Cl)cc1 |c:57|
BDBM189800 COCC1CCC(CNc2ccc(cc2[N+]([O-])=O)S(=O)(=O)NC(=O)c2ccc(cc2Oc2cnc3[nH]ccc3c2)N2CCN(CC3=C(CC(C)(C)CC3)c3ccc(Cl)cc3)CC2)CC1 |t:49,(-10.07,6.16,;-8.53,6.16,;-7.76,4.83,;-6.22,4.83,;-5.45,3.49,;-3.91,3.49,;-3.14,4.83,;-1.6,4.83,;-.83,6.16,;.71,6.16,;1.48,4.83,;3.02,4.83,;3.79,6.16,;3.02,7.49,;1.48,7.49,;.71,8.83,;1.48,10.16,;-.83,8.83,;5.33,6.16,;5.33,7.7,;6.87,6.16,;5.33,4.62,;6.67,3.85,;8,4.62,;6.67,2.31,;8,1.54,;8,,;6.67,-.77,;5.33,,;5.33,1.54,;4,2.31,;2.67,1.54,;2.67,,;1.33,-.77,;;-1.46,-.48,;-2.37,.77,;-1.46,2.02,;,1.54,;1.33,2.31,;6.67,-2.31,;8,-3.08,;8,-4.62,;6.67,-5.39,;6.67,-6.93,;8,-7.7,;8,-9.24,;9.34,-10.01,;10.67,-9.24,;11.49,-10.55,;12.21,-9.29,;10.67,-7.7,;9.34,-6.93,;6.67,-10.01,;6.67,-11.55,;5.33,-12.32,;4,-11.55,;2.67,-12.32,;4,-10.01,;5.33,-9.24,;5.33,-4.62,;5.33,-3.08,;-3.91,6.16,;-5.45,6.16,)|
BDBM189801 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3cnc(OCC4CCN(CC4)c4nccs4)c(Cl)c3)c(Oc3cnc4[nH]ccc4c3)c2)=C(C1)c1ccc(Cl)cc1 |c:61|
BDBM189716 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(OCC4(F)CCOCC4)c(Cl)c3)c(Oc3cnc4[nH]ccc4c3)c2)=C(C1)c1ccc(Cl)cc1 |c:56|
BDBM189717 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3cnc(OCC4CCC(F)(F)CC4)c(Cl)c3)c(Oc3cnc4[nH]ccc4c3)c2)=C(C1)c1ccc(Cl)cc1 |c:57|
BDBM189718 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3cnc(OCC4(F)CCN(CC4)C(CF)CF)c(c3)C(F)(F)F)c(Oc3cnc4[nH]ccc4c3)c2)=C(C1)c1ccc(Cl)cc1 |c:64|
BDBM177833 CN(C)C[C@@H]1Cc2ccccc2CN1C(=O)c1ccc(Cl)cc1-c1cc(C(=O)N(c2ccc(O)cc2)c2ccc3n(C)ccc3c2)c2CCCCn12
BDBM177834 COc1ccc(cc1C(F)(F)F)N(C(=O)c1cc(-c2cc(Cl)ccc2C(=O)N2Cc3ccccc3C[C@H]2CN2CCOCC2)n2CCCCc12)c1ccc(O)cc1
BDBM177835 CSc1ccc(cc1C(F)(F)F)N(C(=O)c1cc(-c2cc(Cl)ccc2C(=O)N2Cc3ccccc3C[C@H]2CN2CCOCC2)n2CCCCc12)c1ccc(O)cc1
BDBM177896 Cc1cccc(c1)N(C(=O)c1cc(-c2cc(Cl)ccc2C(=O)N2Cc3ccccc3C[C@H]2CN2CCOCC2)n2CCCCc12)c1ccc(O)cc1
BDBM177897 Oc1ccc(cc1)N(C(=O)c1cc(-c2cc3OCOc3cc2C(=O)N2Cc3ccccc3C[C@H]2CN2CCN(CC(F)(F)F)CC2)n2CCCCc12)c1ccccc1
BDBM177898 CN1CCN(C[C@@H]2Cc3ccccc3CN2C(=O)c2cc3OCOc3cc2-c2cc(C(=O)N(c3ccccc3)c3ccc(O)cc3)c3CCCCn23)CC1=O
BDBM177899 Oc1ccc(cc1)N(C(=O)c1cc(-c2cc(Cl)ccc2C(=O)N2Cc3ccccc3C[C@H]2CN2CCOCC2)n2CCCCc12)c1ccc(cc1)C#N
BDBM189582 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(N[C@@H]4CCN(C4)C4CC4)c(c3)[N+]([O-])=O)c(Oc3cnc4[nH]ccc4c3)c2)=C(C1)c1ccc(Cl)cc1 |c:59|
BDBM189583 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(NC[C@@H]4CCN(C4)C4CCOCC4)c(c3)[N+]([O-])=O)c(Oc3cnc4[nH]ccc4c3)c2)=C(C1)c1ccc(Cl)cc1 |c:63|
BDBM189584 CC(C)(CO)CNc1ccc(cc1[N+]([O-])=O)S(=O)(=O)NC(=O)c1ccc(cc1Oc1cnc2[nH]ccc2c1)N1CCN(CC2=C(CC(C)(C)CC2)c2ccc(Cl)cc2)CC1 |t:47|
BDBM189630 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(OCC4(F)CCN(CC4)C4CCOC4)c(c3)[N+]([O-])=O)c(Oc3cnc4[nH]ccc4c3)c2)=C(C1)c1ccc(Cl)cc1 |c:64|
BDBM189631 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(OCC4(F)CCN(CC4)S(C)(=O)=O)c(c3)[N+]([O-])=O)c(Oc3cnc4[nH]ccc4c3)c2)=C(C1)c1ccc(Cl)cc1 |c:62|
BDBM189783 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3cnc(OCC4(F)CCC(C)(O)CC4)c(Cl)c3)c(Oc3cnc4[nH]ccc4c3)c2)=C(C1)c1ccc(Cl)cc1 |c:58,(-2.67,-10.52,;-1.85,-9.21,;-3.39,-9.27,;-1.85,-7.67,;-.52,-6.9,;.82,-7.67,;2.15,-6.9,;2.15,-5.36,;3.48,-4.59,;3.48,-3.05,;2.15,-2.28,;.82,-3.05,;.82,-4.59,;2.15,-.74,;3.48,.03,;3.48,1.57,;2.15,2.34,;2.15,3.88,;.82,4.65,;3.48,4.65,;4.82,3.88,;5.59,5.21,;4.05,2.54,;6.15,3.11,;6.15,1.57,;7.48,.8,;8.82,1.57,;10.15,.8,;10.15,-.74,;11.48,-1.51,;11.38,.02,;13.02,-1.46,;13.84,-2.76,;13.12,-4.12,;14.45,-4.89,;13.22,-5.66,;11.58,-4.18,;10.76,-2.87,;8.82,3.11,;10.15,3.88,;7.48,3.88,;.82,1.57,;-.52,2.34,;-1.85,1.57,;-1.85,.03,;-3.19,-.74,;-4.52,.03,;-5.98,-.45,;-6.89,.8,;-5.98,2.04,;-4.52,1.57,;-3.19,2.34,;.82,.03,;.82,-9.21,;-.52,-9.98,;2.15,-9.98,;3.48,-9.21,;4.82,-9.98,;4.82,-11.52,;6.15,-12.29,;3.48,-12.29,;2.15,-11.52,)|
BDBM189744 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3cnc(OC[C@@H]4CN(CCO4)C4CC4)c(Cl)c3)c(Oc3cnc4[nH]ccc4c3)c2)=C(C1)c1ccc(Cl)cc1 |c:59|
BDBM189745 CC1(C)CCC(CC2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(NCC4CCOCC4)c(c3)[N+]([O-])=O)c(Oc3cnc4[nH]ccc4c3)c2)=C(C1)c1ccc(Cl)cc1 |c:57|
BDBM189746 CC1(C)CCC(CC2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(OCC4CCOCC4)c(Cl)c3)c(Oc3cnc4[nH]ccc4c3)c2)=C(C1)c1ccc(Cl)cc1 |c:55|
BDBM189785 CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(OCC4(F)CCN(CC4)C4COC4)c(c3)C#N)c(Oc3cnc4[nH]ccc4c3)c2)=C(C1)c1ccc(Cl)cc1 |c:62|
BDBM189786 CCC1(O)CCC(CNc2ccc(cc2[N+]([O-])=O)S(=O)(=O)NC(=O)c2ccc(cc2Oc2cnc3[nH]ccc3c2)N2CCN(CC3=C(CC(C)(C)CC3)c3ccc(Cl)cc3)CC2)CC1 |t:49,(-12.08,6.12,;-10.77,6.93,;-9.41,6.21,;-10.77,5.49,;-8.64,4.88,;-7.1,4.88,;-6.33,6.21,;-4.79,6.21,;-4.02,7.55,;-2.48,7.55,;-1.71,6.21,;-.17,6.21,;.6,7.55,;-.17,8.88,;-1.71,8.88,;-2.48,10.21,;-1.71,11.55,;-4.02,10.21,;2.14,7.55,;2.14,9.09,;3.68,7.55,;2.14,6.01,;3.47,5.24,;4.81,6.01,;3.47,3.7,;4.81,2.93,;4.81,1.39,;3.47,.62,;2.14,1.39,;2.14,2.93,;.81,3.7,;-.53,2.93,;-.53,1.39,;-1.86,.62,;-3.19,1.39,;-4.66,.91,;-5.56,2.16,;-4.66,3.4,;-3.19,2.93,;-1.86,3.7,;3.47,-.92,;4.81,-1.69,;4.81,-3.23,;3.47,-4,;3.47,-5.54,;4.81,-6.31,;4.81,-7.85,;6.14,-8.62,;7.48,-7.85,;8.29,-9.16,;9.01,-7.91,;7.48,-6.31,;6.14,-5.54,;3.47,-8.62,;3.47,-10.16,;2.14,-10.93,;.81,-10.16,;-.53,-10.93,;.81,-8.62,;2.14,-7.85,;2.14,-3.23,;2.14,-1.69,;-7.1,7.55,;-8.64,7.55,)|
BDBM189787 COCC1(C)CCC(=C(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(NCC4CCOCC4)c(c3)[N+]([O-])=O)c(Oc3cnc4[nH]ccc4c3)c2)C1)c1ccc(Cl)cc1 |t:7|
BDBM60411 COCCc1c(cc(-c2cc3OCOc3cc2C(=O)N2Cc3ccccc3C[C@H]2CN2CCOCC2)n1C)C(=O)N(c1ccc(O)cc1)c1cnc2ccn(C)c2c1
BDBM60412 CN1C=CC2N=CC(=CC12)N(C(=O)c1cc(-c2cc(Cl)ccc2C(=O)N2Cc3ccccc3C[C@H]2CN2CCOCC2)n(C)c1C)c1ccc(O)cc1 |c:2,5,7|