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173 SMILES Strings for Lysosomal Pro-X carboxypeptidase

Compound NameSMILES String
BDBM50001299 OC(=O)C(F)(F)F.Fc1ccc(cc1)-c1cc([nH]n1)C1(CCN(CCc2ccccc2)CC1)c1ccccc1
BDBM50001308 OC(=O)C(F)(F)F.Cn1nc(cc1C1(CCN(CCc2ccccc2)CC1)c1ccccn1)-c1ccc(F)cc1
BDBM50001314 OC(=O)C(F)(F)F.Fc1ccc(cc1)[C@@H]1C[C@@H](CC[C@H]1C(=O)N1CC(C1)(c1ccccc1)c1ccccc1)NCc1ccc(Cl)cc1 |r|
BDBM50001326 OC(=O)C(F)(F)F.Fc1ccc(cc1)[C@@H]1CN(CC(=O)c2ccccc2)CC[C@H]1c1cc(n[nH]1)-c1ccc(Cl)cc1 |r|
BDBM50001445 OC(=O)C(F)(F)F.CC(C)(C)CN1CC[C@H]([C@@H](C1)c1ccc(F)cc1)c1cc(n[nH]1)-c1ccc(Cl)cc1 |r|
BDBM50001304 OC(=O)C(F)(F)F.Cn1nc(cc1C1(CCN(CCc2ccccc2)CC1)c1ccccc1)-c1ccc(F)cc1
BDBM50001312 OC(=O)C(F)(F)F.Clc1ccc(cc1)-c1cc([nH]n1)[C@@H]1CC[C@H](C[C@H]1c1ccc(Br)cc1)N1CCOCC1 |r|
BDBM50001316 OC(=O)C(F)(F)F.Fc1ccc(cc1)[C@@H]1CN(CCc2ccc(Cl)cc2)CC[C@H]1c1cc(n[nH]1)-c1ccc(Cl)cc1 |r|
BDBM50001318 OC(=O)C(F)(F)F.Fc1ccc(cc1)[C@@H]1CN(CCc2ccccc2)CC[C@H]1c1cc(n[nH]1)-c1ccc(Cl)cc1 |r|
BDBM50001321 OC(=O)C(F)(F)F.Fc1ccc(cc1)[C@H]1CN(CCc2ccccc2)CC[C@H]1c1cc(n[nH]1)-c1ccc(Cl)cc1 |r|
BDBM50001322 OC(=O)C(F)(F)F.OC(CN1CC[C@H]([C@@H](C1)c1ccc(F)cc1)c1cc(n[nH]1)-c1ccc(Cl)cc1)c1ccccc1 |r|
BDBM50001329 OC(=O)C(F)(F)F.Fc1ccc(cc1)[C@@H]1CN(CCC(F)(F)F)CC[C@H]1c1cc(n[nH]1)-c1ccc(Cl)cc1 |r|
BDBM50328522 CC(C)(C)c1cnc([nH]1)[C@@H]1CCCN1C(=O)[C@H](Cc1ccc(cc1)-c1ccccc1)NC(=O)C(C)(C)O |r|
BDBM50328523 C[C@H]([C@H](NC(=O)C(C)(C)N)C(=O)N1CCC[C@H]1c1nc2cc(Cl)c(Cl)cc2[nH]1)c1ccc(cc1)-c1ccccc1 |r|
BDBM50328524 C[C@H]([C@H](NC(=O)C(C)(C)N)C(=O)N1CCC[C@H]1c1nc2cc(Cl)c(Cl)cc2[nH]1)c1ccccc1 |r|
BDBM50328525 C[C@H]([C@H](NC(=O)C(C)(C)O)C(=O)N1CCC[C@H]1c1nc2cc(Cl)c(Cl)cc2[nH]1)c1ccccc1 |r|
BDBM50328530 Fc1cccc(c1)-c1c[nH]c(n1)[C@@H]1CCCN1C(=O)CCc1ccc(cc1)-c1ccccc1 |r|
BDBM50328534 CC(C)(N)C(=O)N[C@@H](Cc1ccc(cc1)-c1ccccc1)C(=O)N1CCC[C@H]1c1nc2cc(Cl)c(Cl)cc2[nH]1 |r|
BDBM50328536 COc1ccc(C[C@H](NC(=O)C(C)(C)N)C(=O)N2CC[C@H]2c2nc3cc(Cl)c(Cl)cc3[nH]2)cc1 |r|
BDBM50328539 CC(C)(C)c1cnc([nH]1)[C@@H]1CCCN1C(=O)[C@H](Cc1ccc(cc1)-c1ccccc1)NC(=O)C(C)(C)N |r|
BDBM50338005 CS(=O)(=O)c1ccc(cc1)-c1noc(n1)C1CCN(CCC(=O)N2CCC[C@H]2c2nc3cc(Cl)c(Cl)cc3[nH]2)C(=O)C1 |r|
BDBM50338006 CC(C)(CCCC(=O)N1CCC[C@H]1c1nc2cc(Cl)c(Cl)cc2[nH]1)N1CCC(CC1)c1nc(no1)-c1ccccn1 |r|
BDBM50338007 Cn1nc(cc1-c1ccncc1)C1CCN(CCC(=O)N2CCC[C@H]2c2nc3cc(Cl)c(Cl)cc3[nH]2)CC1 |r|
BDBM50338008 Cn1nc(cc1-c1cccnc1)C1CCN(CCC(=O)N2CCC[C@H]2c2nc3cc(Cl)c(Cl)cc3[nH]2)CC1 |r|
BDBM50338009 Clc1cc2nc([nH]c2cc1Cl)[C@@H]1CCCN1C(=O)CCN1CCC(CC1)c1cc(n[nH]1)-c1ccncc1 |r|
BDBM50338010 Clc1cc2nc([nH]c2cc1Cl)[C@@H]1CCCN1C(=O)CCN1CCC(CC1)c1ccccc1 |r|
BDBM50338013 Clc1cc2nc([nH]c2cc1Cl)[C@@H]1CCCN1C(=O)CCN1CCN(CC1)c1ccccc1 |r|
BDBM50338014 Clc1cc2nc([nH]c2cc1Cl)[C@@H]1CCCN1C(=O)CCN1CCC(CC1)c1ccn[nH]1 |r|
BDBM50338016 Clc1cc2nc([nH]c2cc1Cl)[C@@H]1CCCN1C(=O)CCN1CCC(CC1)c1cn[nH]c1 |r|
BDBM50338021 Clc1cc2nc([nH]c2cc1Cl)[C@@H]1CCCN1C(=O)CCN1CCC(CC1)n1ncnn1 |r|
BDBM50338023 Clc1cc2nc([nH]c2cc1Cl)[C@@H]1CCCN1C(=O)CCN1CCC(CC1)c1ccncc1 |r|
BDBM50338026 Clc1cc2nc([nH]c2cc1Cl)[C@@H]1CCCN1C(=O)CCN1CCC(CC1)c1cnccn1 |r|
BDBM50338027 Clc1cc2nc([nH]c2cc1Cl)[C@@H]1CCCN1C(=O)CCN1CCC(CC1)c1nc(no1)-c1ccccn1 |r|
BDBM50338028 Clc1cc2nc([nH]c2cc1Cl)[C@@H]1CCCN1C(=O)CCN1CCC(CC1)c1nc(no1)-c1cccnc1 |r|
BDBM50338029 Clc1cc2nc([nH]c2cc1Cl)[C@@H]1CCCN1C(=O)CCN1CCC(CC1)c1nc(no1)-c1ccncc1 |r|
BDBM50338030 Clc1cc2nc([nH]c2cc1Cl)[C@@H]1CCCN1C(=O)CCN1CCC(CC1)c1nc(no1)-c1cnccn1 |r|
BDBM50338031 Clc1cc2nc([nH]c2cc1Cl)[C@@H]1CCCN1C(=O)CCN1CCC(CC1)c1nc(no1)-c1ncccn1 |r|
BDBM50338033 CS(=O)(=O)c1ccc(cc1)-c1noc(n1)C1CCN(CCC(=O)N2CCC[C@H]2c2nc3cc(Cl)c(Cl)cc3[nH]2)CC1 |r|
BDBM50338034 OC(=O)c1ccc(cc1)-c1noc(n1)C1CCN(CCC(=O)N2CCC[C@H]2c2nc3cc(Cl)c(Cl)cc3[nH]2)CC1 |r|
BDBM50364385 C[C@H](NC(=O)[C@H](Cc1cccc(c1)C#N)NC(=O)C(C)(C)N)c1nc2cc(Cl)c(Cl)cc2[nH]1 |r|
BDBM50364386 C[C@H](NC(=O)[C@@H](NC(=O)C(C)(C)N)[C@@H](C)c1ccc(OCC(F)(F)F)cc1)c1nc2cc(Cl)c(Cl)cc2[nH]1 |r|
BDBM50364387 C[C@H](NC(=O)[C@@H](NC(=O)C(C)(C)O)[C@@H](C)c1ccc(OCC(F)(F)F)cc1)c1nc2cc(Cl)c(Cl)cc2[nH]1 |r|
BDBM50364388 C[C@H](NC(=O)[C@@H](NC(=O)C(C)(C)O)[C@@H](C)c1ccc(cc1)-c1cn[nH]c1)c1nc2cc(Cl)c(Cl)cc2[nH]1 |r|
BDBM50364393 C[C@H](NC(=O)CCN1CCN(CC1)c1cccc(F)c1)c1nc2cc(Cl)c(Cl)cc2[nH]1 |r|
BDBM50364394 C[C@H](NC(=O)CCN1CCN(CC1)c1ccc(F)cc1)c1nc2cc(Cl)c(Cl)cc2[nH]1 |r|
BDBM50364406 C[C@H](NC(=O)[C@@H](N)[C@@H](C)c1ccc(cc1)-c1ccccc1)c1nc2cc(Cl)c(Cl)cc2[nH]1 |r|
BDBM50364407 C[C@H](NC(=O)[C@@H](NC(=O)C(C)(C)N)[C@@H](C)c1ccc(cc1)-c1ccccc1)c1nc2cc(Cl)c(Cl)cc2[nH]1 |r|
BDBM50364408 C[C@H](NC(=O)[C@H](Cc1ccc(cc1)-c1ccccc1)NCC(C)(C)N)c1nc2cc(Cl)c(Cl)cc2[nH]1 |r|
BDBM50364409 C[C@H](NC(=O)[C@@H](N)Cc1cccc(c1)C#N)c1nc2cc(Cl)c(Cl)cc2[nH]1 |r|
BDBM50364666 FC(F)(F)Oc1ccc(CN2CCC3(CC2)OC(c2ccccc32)c2cc(Cl)cc(Cl)c2)cc1
BDBM50364667 Clc1cc(Cl)cc(c1)C1OC2(CCN(Cc3cc4ccccc4o3)CC2)c2ccccc12
BDBM50364668 Fc1ccc(CN2CCC3(CC2)OC(c2ccccc32)c2cc(Cl)cc(Cl)c2)nc1
BDBM50364669 FC(F)(F)c1ccc(CN2CCC3(CC2)OC(c2ccccc32)c2cc(Cl)cc(Cl)c2)nc1
BDBM50364670 Clc1cc(Cl)cc(c1)C1OC2(CCN(Cc3ccc(cn3)N3CCCC3)CC2)c2ccccc12
BDBM50364672 FC(F)(F)Oc1ccc(CN2CCC3(CC2)OC(c2cccnc32)c2cc(Cl)cc(Cl)c2)cc1
BDBM50364673 FC(F)(F)Oc1ccc(CN2CCC3(CC2)OC(c2ccncc32)c2cc(Cl)cc(Cl)c2)cc1
BDBM50364674 FC(F)(F)Oc1ccc(CN2CCC3(CC2)OC(c2cnccc32)c2cc(Cl)cc(Cl)c2)cc1
BDBM50364676 FC(F)(F)Oc1ccc(CN2CCC3(CC2)OC(c2ccccc32)c2cc(Cl)ccn2)cc1
BDBM50364677 FC(F)(F)Oc1ccc(CN2CCC3(CC2)OC(c2ccccc32)c2ccc(Cl)cn2)cc1
BDBM50364678 FC(F)(F)Oc1ccc(CN2CCC3(CC2)OC(c2ccccc32)c2ccccn2)cc1
BDBM50364679 [O-][n+]1ccc(Cl)cc1C1OC2(CCN(Cc3ccc(OC(F)(F)F)cc3)CC2)c2ccccc12
BDBM50364680 FC(F)(F)Oc1ccc(CN2CCC3(CC2)OC(c2cccnc32)c2cc(Cl)ccn2)cc1
BDBM50364681 CC(N1CCC2(CC1)OC(c1ccccc21)c1cc(Cl)ccn1)c1ccc(F)cn1
BDBM50364682 FC(F)(F)Oc1ccc(cc1)S(=O)(=O)N1CCC2(CC1)OC(c1cccnc21)c1cc(Cl)cc(Cl)c1
BDBM50364683 CC(N1CCC2(CC1)OC(c1cccnc21)c1cc(Cl)ccn1)c1ccc(F)cn1
BDBM50364684 CC(N1CCC2(CC1)OC(c1cccnc21)c1cc(Cl)cc(Cl)c1)c1ccc(F)cn1
BDBM50364685 CC(N1CCC2(CC1)OC(c1ccccc21)c1cc(Cl)cc(Cl)c1)c1ccc(F)cn1
BDBM50364686 OCC(N1CCC2(CC1)OC(c1cccnc21)c1cc(Cl)cc(Cl)c1)c1ccccc1
BDBM50364687 CC(C)(N1CCC2(CC1)OC(c1cccnc21)c1cc(Cl)ccn1)c1ccc(OC(F)(F)F)cc1
BDBM50364688 CC(C)(O)C(N1CCC2(CC1)OC(c1cccnc21)c1cc(Cl)cc(Cl)c1)c1ccccc1
BDBM50364689 [O-][n+]1ccc(Cl)cc1C1OC2(CCN(CC2)S(=O)(=O)c2ccc(cn2)C(F)(F)F)c2ccccc12
BDBM50361751 C[C@H](NC(=O)CCN1CCC(CC1)c1nc(no1)-c1ccccn1)c1ccc(F)cc1 |r|
BDBM50361753 FC(F)C(NC(=O)CCN1CCC(CC1)c1nc(no1)-c1ccccn1)c1ccc(Cl)cc1
BDBM50361757 Clc1ccc(cc1)C(NC(=O)CCN1CCC(CC1)c1nc(no1)-c1ccccn1)c1ccc(Cl)cc1
BDBM50361758 Fc1ccc(cc1)C(NC(=O)CCN1CCC(CC1)c1nc(no1)-c1ccccn1)c1ccncc1
BDBM50361765 C[C@H](NC(=O)[C@@H](N)[C@@H](C)c1ccc(cc1)-c1ccccc1)c1ccc(Cl)cc1 |r|
BDBM50361766 C[C@H](NC(=O)[C@@H](NC(=O)C(C)(C)N)[C@@H](C)c1ccc(cc1)-c1ccccc1)c1ccc(Cl)cc1 |r|
BDBM50361770 C[C@H]([C@H](NC(=O)C(C)(C)N)C(=O)NC(C(F)F)c1ccc(Cl)cc1)c1ccc(cc1)-c1ccccc1 |r|
BDBM50361773 C[C@H]([C@H](N)C(=O)NC(c1ccncc1)c1ccc(Cl)cc1)c1ccc(cc1)-c1ccccc1 |r|
BDBM50361774 C[C@H]([C@H](NC(=O)C(C)(C)N)C(=O)NC(c1ccncc1)c1ccc(Cl)cc1)c1ccc(cc1)-c1ccccc1 |r|
BDBM50361778 C[C@H](NC(=O)CCN1CCC(CC1)c1ccccc1)c1ccc(Cl)cc1 |r|
BDBM50361779 C[C@H](NC(=O)CCN1CCC(CC1)c1ccccc1)c1ccc(Br)cc1 |r|
BDBM50361780 CC(C)[C@H](NC(=O)CCN1CCC(CC1)c1ccccc1)c1ccc(Cl)cc1 |r|
BDBM50361782 FC(F)C(NC(=O)CCN1CCC(CC1)c1ccccc1)c1ccc(Cl)cc1
BDBM50361783 FC(F)(F)C(NC(=O)CCN1CCC(CC1)c1ccccc1)c1ccc(Cl)cc1
BDBM50361784 Clc1ccc(cc1)C(NC(=O)CCN1CCC(CC1)c1ccccc1)c1ccc(Cl)cc1
BDBM50361786 Clc1ccc(cc1)C(NC(=O)CCN1CCC(CC1)c1ccccc1)c1ccncc1
BDBM50361790 Cn1cc(cn1)C(NC(=O)CCN1CCC(CC1)c1ccccc1)c1ccc(Cl)cc1
BDBM50361791 CC(NC(=O)CCN1CCC(CC1)c1ccccc1)c1ccccc1-c1ccccc1
BDBM50382886 Cc1nc(C2CCN(CC2)C(=O)[C@@H]2CN(C[C@H]2c2ccc(F)cc2F)C(C)(C)C)n(n1)-c1ccc(Cl)c(C)c1 |r|
BDBM50382887 Cc1cc(C2CCN(CC2)C(=O)[C@@H]2CN(C[C@H]2c2ccc(F)cc2F)C(C)(C)C)n(n1)-c1cccc(Cl)c1 |r|
BDBM50382888 Cc1cc(C2CCN(CC2)C(=O)[C@@H]2CN(C[C@H]2c2ccc(F)cc2F)C(C)(C)C)n(n1)-c1ccc(F)cc1F |r|
BDBM50382889 Cc1nc(C2CCN(CC2)C(=O)[C@@H]2CNC[C@H]2c2ccc(F)cc2F)n(n1)-c1ccc(F)c(Cl)c1 |r|
BDBM50382890 Cc1nc(C2CCN(CC2)C(=O)[C@H]2CN(C[C@@H]2c2ccc(F)cc2F)C(C)(C)C)n(n1)-c1ccc(Cl)c(C)c1 |r|
BDBM50382891 Cc1nc(nn1-c1ccc(Cl)c(C)c1)C1CCN(CC1)C(=O)[C@@H]1CN(C[C@H]1c1ccc(F)cc1F)C(C)(C)C |r|
BDBM50382892 Cc1nc(C2CCN(CC2)C(=O)[C@@H]2CN(C[C@H]2c2ccc(F)cc2F)C(C)(C)C)n(n1)-c1ccc(Cl)cc1 |r|
BDBM50382893 Cc1nc(C2CCN(CC2)C(=O)[C@@H]2CN(C[C@H]2c2ccc(F)cc2F)C(C)(C)C)n(n1)-c1ccc(F)c(F)c1 |r|
BDBM50382897 Cc1cc(C2CCN(CC2)C(=O)[C@@H]2CN(C[C@H]2c2ccc(F)cc2F)C(C)(C)C)n(n1)-c1ccc(Cl)c(C)c1 |r|
BDBM50382898 Cc1cc(C2CCN(CC2)C(=O)[C@@H]2CN(C[C@H]2c2ccc(F)cc2F)C(C)(C)C)n(n1)-c1ccc(Cl)cc1C |r|
BDBM50382899 Cc1cc(C2CCN(CC2)C(=O)[C@@H]2CN(C[C@H]2c2ccc(F)cc2F)C(C)(C)C)n(n1)-c1ccc(C)c(Cl)c1 |r|
BDBM50382900 Cc1cc(C2CCN(CC2)C(=O)[C@@H]2CN(C[C@H]2c2ccc(F)cc2F)C(C)(C)C)n(n1)-c1ccc(Cl)cc1 |r|
BDBM50382902 CC(C)(C)N1C[C@H]([C@@H](C1)c1ccc(F)cc1F)C(=O)N1CCC(CC1)c1nnnn1-c1ccc(Cl)cc1 |r|
BDBM50382904 Cc1cc(C2CCN(CC2)C(=O)[C@@H]2CN(C[C@H]2c2ccc(F)cc2F)C(C)(C)C)n(n1)-c1ccc(Cl)c(Cl)c1 |r|
BDBM50382905 Cc1cc(C2CCN(CC2)C(=O)[C@@H]2CN(C[C@H]2c2ccc(F)cc2F)C(C)(C)C)n(n1)-c1ccc(Cl)cc1Cl |r|
BDBM50382906 Cc1cc(C2CCN(CC2)C(=O)[C@@H]2CN(C[C@H]2c2ccc(F)cc2F)C(C)(C)C)n(n1)-c1cc(Cl)ccc1Cl |r|
BDBM50382907 Cc1cc(C2CCN(CC2)C(=O)[C@@H]2CN(C[C@H]2c2ccc(F)cc2F)C(C)(C)C)n(n1)-c1ccc(F)cc1 |r|
BDBM50382909 Cc1cc(C2CCN(CC2)C(=O)[C@@H]2CN(C[C@H]2c2ccc(F)cc2F)C(C)(C)C)n(n1)-c1ccc(F)c(F)c1 |r|
BDBM50382910 Cc1cc(C2CCN(CC2)C(=O)[C@@H]2CN(C[C@H]2c2ccc(F)cc2F)C(C)(C)C)n(n1)-c1ccc(Cl)cc1F |r|
BDBM50382911 Cc1cc(C2CCN(CC2)C(=O)[C@@H]2CN(C[C@H]2c2ccc(F)cc2F)C(C)(C)C)n(n1)-c1ccc(Cl)c(F)c1 |r|
BDBM50382912 Cc1cc(C2CCN(CC2)C(=O)[C@@H]2CN(C[C@H]2c2ccc(F)cc2F)C(C)(C)C)n(n1)-c1ccc(F)c(Cl)c1 |r|
BDBM50382913 CC(C)(C)N1C[C@H]([C@@H](C1)c1ccc(F)cc1F)C(=O)N1CCC(CC1)c1ccnn1-c1ccc(F)c(Cl)c1 |r|
BDBM50382914 Cc1cc(C2CCN(CC2)C(=O)[C@@H]2CN(C[C@H]2c2ccc(F)cc2F)C(C)(C)C)n(n1)-c1cc(Cl)ccc1F |r|
BDBM50382915 Cc1cc(C2CCN(CC2)C(=O)[C@@H]2CN(C[C@H]2c2ccc(F)cc2F)C(C)(C)C)n(n1)-c1cc(F)ccc1Cl |r|
BDBM50382916 Cc1nc(C2CCN(CC2)C(=O)[C@@H]2CNC[C@H]2c2ccc(F)cc2F)n(n1)-c1ccc(Cl)cc1 |r|
BDBM50382917 Cc1nc(C2CCN(CC2)C(=O)[C@@H]2CNC[C@H]2c2ccc(F)cc2F)n(n1)-c1ccc(Cl)c(Cl)c1 |r|
BDBM50382918 Cc1nc(C2CCN(CC2)C(=O)[C@@H]2CNC[C@H]2c2ccc(F)cc2F)n(n1)-c1cc(Cl)ccc1Cl |r|
BDBM50382919 Cc1cc(C2CCN(CC2)C(=O)[C@@H]2CNC[C@H]2c2ccc(F)cc2F)n(n1)-c1ccc(Cl)c(Cl)c1 |r|
BDBM50382920 Cc1cc(C2CCN(CC2)C(=O)[C@@H]2CNC[C@H]2c2ccc(F)cc2F)n(n1)-c1cc(Cl)ccc1Cl |r|
BDBM50382921 Cc1cc(C2CCN(CC2)C(=O)[C@@H]2CNC[C@H]2c2ccc(F)cc2F)n(n1)-c1ccc(F)c(Cl)c1 |r|
BDBM50382922 Fc1ccc([C@@H]2CNC[C@H]2C(=O)N2CCC(CC2)c2ccnn2-c2ccc(F)c(Cl)c2)c(F)c1 |r|
BDBM50365041 C[C@H](Nc1cc(N[C@H]2CC[C@@H](CC2)c2ccccc2)ncn1)c1ccc(Cl)cc1 |r,wU:1.0,7.6,wD:10.13,(24.95,-25.73,;24.95,-27.27,;23.61,-28.04,;22.28,-27.27,;20.94,-28.05,;19.6,-27.27,;18.26,-28.04,;16.93,-27.26,;15.6,-28.04,;14.27,-27.25,;14.28,-25.71,;15.62,-24.95,;16.95,-25.73,;12.95,-24.93,;12.97,-23.39,;11.65,-22.61,;10.31,-23.37,;10.3,-24.92,;11.63,-25.69,;19.61,-25.73,;20.95,-24.96,;22.28,-25.73,;26.28,-28.04,;26.28,-29.58,;27.61,-30.35,;28.94,-29.58,;30.28,-30.35,;28.94,-28.03,;27.61,-27.27,)|
BDBM50365042 C[C@H](Nc1cc(N[C@H]2CC[C@@H](CC2)NS(C)(=O)=O)ncn1)c1ccc(Cl)cc1 |r,wU:1.0,7.6,wD:10.13,(12.59,-35.16,;12.59,-36.7,;11.26,-37.47,;9.93,-36.7,;8.58,-37.47,;7.25,-36.7,;5.91,-37.46,;4.58,-36.69,;3.25,-37.46,;1.92,-36.68,;1.93,-35.14,;3.27,-34.38,;4.59,-35.15,;.6,-34.36,;-.74,-35.12,;-2.07,-34.34,;-1.52,-36.45,;.02,-36.46,;7.26,-35.16,;8.6,-34.39,;9.93,-35.16,;13.93,-37.47,;13.93,-39.01,;15.26,-39.78,;16.59,-39.01,;17.93,-39.77,;16.59,-37.46,;15.25,-36.7,)|
BDBM50365007 Clc1cc2nc([nH]c2cc1Cl)[C@@H]1CCCN1c1cc(ncn1)N1CCC(C1)c1ccccn1 |r|
BDBM50365008 OC1(CCN(C1)c1cc(ncn1)N1CCC[C@H]1c1nc2cc(Cl)c(Cl)cc2[nH]1)c1ccccc1 |r|
BDBM50365009 CC(C)(O)C1CCCN(C1)c1cc(ncn1)N1CCC[C@H]1c1nc2cc(Cl)c(Cl)cc2[nH]1 |r|
BDBM50365010 Clc1cc2nc([nH]c2cc1Cl)[C@@H]1CCCN1c1cc(ncn1)N1CCCC(C1)N1CCc2c(C1)cccc2-c1cccnc1 |r|
BDBM50365011 C[C@H](Nc1cc(ncn1)N1CCCC(C1)C(C)(C)O)c1ccc(Cl)cc1 |r|
BDBM50365012 C[C@H](N(C)c1cc(ncn1)N1CCCC(C1)C(C)(C)O)c1ccc(Cl)cc1 |r|
BDBM50365013 COC(=O)N[C@H]1CC[C@@H](CC1)Nc1cc(N[C@@H](C)c2ccc(Cl)cc2)ncn1 |r,wU:16.17,8.11,wD:5.4,(30.92,-23.64,;30.91,-25.18,;32.24,-25.96,;32.23,-27.5,;33.58,-25.2,;34.91,-25.98,;34.9,-27.52,;36.23,-28.31,;37.56,-27.53,;37.57,-26,;36.25,-25.22,;38.89,-28.31,;40.23,-27.54,;41.56,-28.32,;42.9,-27.55,;44.24,-28.32,;45.57,-27.54,;45.57,-26,;46.91,-28.31,;46.9,-29.85,;48.24,-30.62,;49.57,-29.85,;50.91,-30.62,;49.57,-28.3,;48.23,-27.54,;42.9,-26.01,;41.57,-25.24,;40.23,-26,)|
BDBM50365020 Clc1cc2nc([nH]c2cc1Cl)[C@@H]1CCCN1c1cc(ncn1)N1CCN(Cc2ccccc2)CC1 |r|
BDBM50365031 Clc1cc2nc([nH]c2cc1Cl)[C@@H]1CCCN1c1cc(ncn1)N1CCO[C@H](C1)c1ccccc1 |r|
BDBM50365032 Clc1cc2nc([nH]c2cc1Cl)[C@@H]1CCCN1c1cc(ncn1)N1CCO[C@@H](C1)c1ccccc1 |r|
BDBM50365033 COc1ccc(cc1)C1CN(CCO1)c1cc(ncn1)N1CCC[C@H]1c1nc2cc(Cl)c(Cl)cc2[nH]1 |r|
BDBM50365034 Clc1cc2nc([nH]c2cc1Cl)[C@@H]1CCCN1c1cc(ncn1)N1CCC(Cn2cccn2)CC1 |r|
BDBM50383432 Cc1nc(C2CCN(CC2)C(=O)[C@@H]2C[C@@](C)(N)C[C@H]2c2ccc(F)cc2F)n(n1)-c1cc(Cl)ccc1Cl |r|
BDBM50383433 CN(C)[C@]1(C)C[C@H]([C@@H](C1)c1ccc(F)cc1F)C(=O)N1CCC(CC1)c1nc(C)nn1-c1cc(Cl)ccc1Cl |r|
BDBM50383434 Cc1nc(C2CCN(CC2)C(=O)[C@@H]2C[C@@](C)(N)C[C@H]2c2ccc(F)cc2F)n(n1)-c1ccc(Cl)c(C)c1 |r|
BDBM50383435 CN(C)[C@]1(C)C[C@H]([C@@H](C1)c1ccc(F)cc1F)C(=O)N1CCC(CC1)c1nc(C)nn1-c1ccc(Cl)c(C)c1 |r|
BDBM50383436 CN(C)[C@H]1C[C@H]([C@@H](C1)c1ccc(F)cc1F)C(=O)N1CCC(CC1)c1nc(C)nn1-c1ccc(Cl)c(C)c1 |r|
BDBM50383437 CN(C)[C@@H]1C[C@H]([C@@H](C1)c1ccc(F)cc1F)C(=O)N1CCC(CC1)c1nc(C)nn1-c1ccc(Cl)c(C)c1 |r|
BDBM50383418 C[C@]1(N)C[C@@H]([C@H](C1)c1ccc(F)cc1F)C(=O)N1CCC(CC1)c1ccnn1-c1ccc(F)c(Cl)c1 |r|
BDBM50383419 C[C@@]1(N)C[C@@H]([C@H](C1)c1ccc(F)cc1F)C(=O)N1CCC(CC1)c1ccnn1-c1ccc(F)c(Cl)c1 |r|
BDBM50383420 CN(C)[C@@]1(C)C[C@@H]([C@H](C1)c1ccc(F)cc1F)C(=O)N1CCC(CC1)c1ccnn1-c1ccc(F)c(Cl)c1 |r|
BDBM50383421 CN(C)[C@]1(C)C[C@@H]([C@H](C1)c1ccc(F)cc1F)C(=O)N1CCC(CC1)c1ccnn1-c1ccc(F)c(Cl)c1 |r|
BDBM50383422 Cc1cc(C2CCN(CC2)C(=O)[C@H]2C[C@@](C)(N)C[C@@H]2c2ccc(F)cc2F)n(n1)-c1ccc(F)c(Cl)c1 |r|
BDBM50383423 Cc1cc(C2CCN(CC2)C(=O)[C@@H]2C[C@](C)(N)C[C@H]2c2ccc(F)cc2F)n(n1)-c1ccc(F)c(Cl)c1 |r|
BDBM50383424 Cc1cc(C2CCN(CC2)C(=O)[C@@H]2C[C@@](C)(N)C[C@H]2c2ccc(F)cc2F)n(n1)-c1ccc(F)c(Cl)c1 |r|
BDBM50383425 CN(C)[C@]1(C)C[C@H]([C@@H](C1)c1ccc(F)cc1F)C(=O)N1CCC(CC1)c1cc(C)nn1-c1ccc(F)c(Cl)c1 |r|
BDBM50383426 Cc1cc(C2CCN(CC2)C(=O)[C@@H]2C[C@@](C)(N)C[C@H]2c2ccc(F)cc2F)n(n1)-c1cc(Cl)ccc1Cl |r|
BDBM50383427 CN(C)[C@]1(C)C[C@H]([C@@H](C1)c1ccc(F)cc1F)C(=O)N1CCC(CC1)c1cc(C)nn1-c1cc(Cl)ccc1Cl |r|
BDBM50383428 C[C@@]1(N)C[C@H]([C@@H](C1)c1ccc(F)cc1F)C(=O)N1CCC(CC1)c1ncnn1-c1ccc(F)c(Cl)c1 |r|
BDBM50383429 Cc1nc(C2CCN(CC2)C(=O)[C@@H]2C[C@](C)(N)C[C@H]2c2ccc(F)cc2F)n(n1)-c1ccc(F)c(Cl)c1 |r|
BDBM50383430 CN(C)[C@]1(C)C[C@H]([C@@H](C1)c1ccc(F)cc1F)C(=O)N1CCC(CC1)c1nc(C)nn1-c1ccc(F)c(Cl)c1 |r|
BDBM50383431 Cc1nc(C2CCN(CC2)C(=O)[C@@H]2C[C@@](C)(N)C[C@H]2c2ccc(F)cc2F)n(n1)-c1ccc(F)c(Cl)c1 |r|
BDBM50443343 CCN(CC)CC(=O)N[C@@H]1CC[C@H]([C@@H](C1)c1ccc(Br)cc1)C(=O)NC(c1ccc(F)cc1)c1ccc(F)cc1 |r|
BDBM50443344 Cc1ccccc1[C@H]1C[C@H](CC[C@@H]1C(=O)N1CC(C1)(c1ccccc1)c1ccccc1)NCc1ccc(Cl)cc1 |r|
BDBM50443345 Clc1ccc(cc1)C(NC(=O)[C@@H]1CC[C@H](C[C@H]1c1ccc(Br)cc1)N1CCOCC1)c1ncccn1 |r|
BDBM50443346 Clc1ccc(cc1)C(NC(=O)[C@@H]1CC[C@H](C[C@H]1c1ccc(Br)cc1)N1CCOCC1)c1cnccn1 |r|
BDBM50443347 Fc1ccc(nc1)C(NC(=O)[C@@H]1CC[C@H](C[C@H]1c1ccc(Br)cc1)N1CCOCC1)c1ccc(Cl)cc1 |r|
BDBM50443348 Fc1cc(ccn1)C(NC(=O)[C@@H]1CC[C@H](C[C@H]1c1ccc(Br)cc1)N1CCOCC1)c1ccc(Cl)cc1 |r|
BDBM50443349 Clc1ccc(cc1)C(NC(=O)[C@@H]1CC[C@H](C[C@H]1c1ccc(Br)cc1)N1CCOCC1)c1ccncc1Cl |r|
BDBM50443350 Cc1cc(ccn1)C(NC(=O)[C@@H]1CC[C@H](C[C@H]1c1ccc(Br)cc1)N1CCOCC1)c1ccc(Cl)cc1 |r|
BDBM50443351 Clc1ccc(cc1)C(NC(=O)[C@@H]1CC[C@H](C[C@H]1c1ccc(Br)cc1)N1CCOCC1)c1ccncc1 |r|
BDBM50443352 Fc1ccc(cc1)C(NC(=O)[C@@H]1CC[C@H](C[C@H]1c1ccc(Br)cc1)N1CCOCC1)c1ccncc1 |r|
BDBM50443353 Fc1ccc(cc1)C(NC(=O)[C@@H]1CC[C@H](C[C@H]1c1ccc(Br)cc1)N1CCOCC1)c1ccc(F)cc1 |r|
BDBM50443354 Clc1ccc(cc1)C(NC(=O)[C@@H]1CC[C@H](C[C@H]1c1ccc(Br)cc1)N1CCOCC1)c1ccc(Cl)cc1 |r|
BDBM50443355 C[C@H](NC(=O)[C@@H]1CC[C@H](C[C@H]1c1ccc(Br)cc1)N1CCOCC1)c1ccc(Cl)cc1 |r|
BDBM50443356 C[C@H](NC(=O)[C@@H]1CC[C@H](C[C@H]1c1ccc(Br)cc1)N1CCOCC1)c1ccc(F)cc1 |r|
BDBM50443357 CN(C(c1ccccc1)c1ccccc1)C(=O)[C@@H]1CC[C@H](C[C@H]1c1ccc(Br)cc1)N1CCOCC1 |r|
BDBM50443358 Brc1ccc(cc1)[C@@H]1C[C@@H](CC[C@H]1C(=O)N1CC(C1)(c1ccccc1)c1ccccc1)N1CCOCC1 |r|
BDBM50443359 Brc1ccc(cc1)[C@@H]1C[C@@H](CC[C@H]1C(=O)NC(c1ccccc1)c1ccccc1)N1CCOCC1 |r|
BDBM50443360 O=C(NC(c1ccccc1)c1ccccc1)[C@@H]1CC[C@H](C[C@H]1c1ccccc1)N1CCOCC1 |r|
BDBM50443361 Cc1ccccc1[C@H]1C[C@@H](CC[C@@H]1C(=O)N1CC(C1)(c1ccccc1)c1ccccc1)NCc1ccc(Cl)cc1 |r|