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1105 SMILES Strings for 5-hydroxytryptamine receptor 1B

Compound NameSMILES String
BDBM10755 NCCc1c[nH]c2ccc(O)cc12
BDBM21392 NCCc1c[nH]c2ccc(cc12)C(N)=O
BDBM21393 CCCN(CCC)C1CCc2cccc(O)c2C1
BDBM21395 Fc1ccc(cc1)C(=O)C1CCN(CCn2c(=O)[nH]c3ccccc3c2=O)CC1
BDBM21397 Fc1ccc(cc1)C(=O)CCCN1CCC2(CC1)N(CNC2=O)c1ccccc1
BDBM21398 OC1(CCN(CCCC(=O)c2ccc(F)cc2)CC1)c1ccc(Cl)cc1
BDBM21280 Cc1ccc(Cn2nc(cc2-c2ccc(Cl)c(C)c2)C(=O)NC2[C@@]3(C)CCC(C3)C2(C)C)cc1 |r,TLB:21:22:28:26.25|
BDBM22864 NCCc1cnc(CCC(c2ccccc2)c2ccccc2)[nH]1
BDBM22867 [H][C@@]12Cc3c[nH]c4cccc(C1=C[C@H](CN2C)NC(=O)N(CC)CC)c34 |r,c:12|
BDBM22869 CN1CCN(CC1)C1=c2ccccc2=Nc2ccc(Cl)cc2N1 |c:8,15|
BDBM25870 CN(C)CCCC1(OCc2cc(ccc12)C#N)c1ccc(F)cc1
BDBM25761 CC(C)NCC(O)COc1cccc2ccccc12
BDBM26739 NC(=O)c1cccc(c1)-c1cccc(OC(=O)NC2CCCCC2)c1
BDBM26948 Fc1ccc(cc1)C(CCCN1CCC2(CC1)N(CNC2=O)c1ccccc1)c1ccc(F)cc1
BDBM29568 COc1cc2nc(nc(N)c2cc1OC)N1CCN(CC1)C(=O)c1ccco1
BDBM28574 NCCC(=O)Nc1ccc2cnn(c2c1)S(=O)(=O)c1cccc2ccccc12
BDBM28579 O=C(Nc1ccc2cnn(c2c1)S(=O)(=O)c1cccc2ccccc12)C1CCNCC1
BDBM28580 O=C(Nc1ccc2cnn(c2c1)S(=O)(=O)c1cccc2ccccc12)C1CCCNC1
BDBM30703 Cc1cc(cc(C)c1CC1=NCCN1)C(C)(C)C |t:10|
BDBM30704 CN1C[C@H](CNC(=O)OCc2ccccc2)C[C@H]2[C@H]1Cc1cn(C)c3cccc2c13
BDBM30707 COc1ccc2[nH]cc(CCN(C)C)c2c1
BDBM30712 Cc1cc(c(O)c(C)c1CC1=NCCN1)C(C)(C)C |t:11|
BDBM34141 COc1ccc2n(cc(CCN(C)C)c2c1)S(=O)(=O)c1ccccc1
BDBM35226 CCOc1ccccc1O[C@H]([C@@H]1CNCCO1)c1ccccc1 |r|
BDBM35255 CN(C)CCOC1=Cc2ccccc2Sc2ccc(Cl)cc12 |t:6|
BDBM55436 C(C1=NCCN1)c1ccccc1 |t:1|
BDBM77970 CN(C)CCCN1c2ccccc2CCc2ccc(Cl)cc12
BDBM78940 CSc1ccc2Sc3ccccc3CC(N3CCN(C)CC3)c2c1
BDBM79215 COc1ccc(NC(=O)c2ccc(cc2)-c2ccc(cc2C)-c2noc(C)n2)cc1N1CCN(C)CC1
BDBM82472 CC(N)Cc1c[nH]c2ccc(OCc3cccs3)cc12
BDBM82071 COc1ccc(cc1)C(CN(C)C)C1(O)CCCCC1
BDBM82368 CCCN(CCCCN1C(=O)CC2(CCCC2)CC1=O)C1COc2cccc(OC)c2C1
BDBM82087 COc1ccc2[nH]cc(CCN)c2c1
BDBM82479 CN1CCN(CC1)C1=c2cc(C)sc2=Nc2ccccc2N1 |c:8,15|
BDBM81789 CCCN(CCC)CCc1c[nH]c2ccc(cc12)C(N)=O
BDBM81790 CCN1CCCC1CNC(=O)c1cc(c(N)cc1OC)S(=O)(=O)CC
BDBM81483 NC(=O)C1(CCN(CCCC(=O)c2ccc(F)cc2)CC1)N1CCCCC1
BDBM81497 CN1CCN(CC1)c1nc2cc(ccc2n2cccc12)C(F)(F)F
BDBM81498 COc1ccc2[nH]cc(C3=CCNCC3)c2c1 |t:9|
BDBM81499 CC(C)(C)NCC(O)COc1cccc2[nH]c(cc12)C#N
BDBM86194 NC(CS(O)=O)C(O)=O
BDBM86195 CSCCC(N)C(O)=O
BDBM86196 N[C@H](CCS(O)(=O)=O)C(O)=O |r|
BDBM86197 N[C@H](CCS(O)=O)C(O)=O |r|
BDBM86199 NC(CSSCC(N)C(O)=O)C(O)=O
BDBM86201 N[C@@H](CCS(O)=O)C(O)=O |r|
BDBM86202 NC(CCS)C(O)=O
BDBM86203 NC(CS)C(O)=O
BDBM86205 N[C@@H]1CCSC1=O |r|
BDBM86038 Nc1c(Cl)cc(-c2nn(C3CCN(CCc4ccccc4)CC3)c(=O)o2)c2OCCOc12
BDBM86170 CN(C)CCc1cnc(CCC(c2ccccc2)c2ccccc2)[nH]1
BDBM86175 CNCCc1cnc(CCC(c2ccccc2)c2ccccc2)[nH]1
BDBM86052 CCNC(=O)N(CCCN(C)C)C(=O)C1CC2C(Cc3c[nH]c4cccc2c34)N(CC=C)C1
BDBM86053 Nc1nc2CCN(CC=C)CCc2s1
BDBM86475 CCCN1CCOC2C1CCc1ccc(cc21)C(N)=O
BDBM84637 CCCN1CCC[C@@H]2Cc3[nH]ncc3C[C@@H]12 |r|
BDBM84737 O=c1ccc2[nH]cc(C3=CCNCC3)c2[nH]1 |t:8|
BDBM84991 Cc1cc(NC(=O)Nc2ccc3n(C)ccc3c2)sn1
BDBM84994 CN1CC2C(C1)c1cc(Cl)ccc1Oc1ccccc21
BDBM84745 CNCC[C@H](Oc1cccc2ccccc12)c1cccs1 |r|
BDBM85473 NC(CS(O)(=O)=O)C(O)=O
BDBM85595 Fc1cccc2OC3CNCC3Oc12
BDBM85608 [#6]-[#6]-1-[#6]-[#6]-[#7](-[#6]-[#6]-[#6@H]-2-[#6]-[#6]-[#6]-[#7]-2[S;v6](=O)(=O)c2ccc(Cl)c(Cl)c2)-[#6]-[#6]-1
BDBM85610 [#6]-[#6]-1-[#6]-[#6]-[#7](-[#6]-[#6]-[#6@H]-2-[#6]-[#6]-[#6]-[#7]-2[S;v6](=O)(=O)c2cccc(Br)c2)-[#6]-[#6]-1
BDBM85612 [#6]-[#6]-1-[#6]-[#6]-[#7](-[#6]-[#6]-[#6@H]-2-[#6]-[#6]-[#6]-[#6]-[#6]-2[S;v6](=O)(=O)c2cccc3ccccc23)-[#6]-[#6]-1
BDBM85613 [#6]-[#6]-1-[#6]-[#6]-[#7](-[#6]-[#6]-[#6]-2-[#6]-[#6]-[#6]-[#6]-[#6]-2[S;v6](=O)(=O)c2cccc3ccccc23)-[#6]-[#6]-1
BDBM85195 CN(C)C1CCc2[nH]c3ccc(NC(=O)c4ccc(F)cc4)cc3c2C1
BDBM85672 O=C(NCCCCN1C[C@@H]2COc3ccc(cc3[C@H]2C1)C#N)c1ccc(cc1)-c1ccccc1 |r|
BDBM85805 COc1ccc2CC(CN(C)C)(c2c1)C1(O)CCCCC1
BDBM85818 CC(CF)NCC(O)COc1cccc2[nH]c3ccccc3c12
BDBM85092 C(N1CCN(CC1)c1ncccn1)c1ccc2OCOc2c1
BDBM85093 Clc1ccc(cc1)N1CCN(Cc2c[nH]c3ncccc23)CC1
BDBM85165 OC(CN1CCN(CC1)c1cccc(Cl)c1)C(c1ccccc1)c1ccccc1
BDBM85166 COc1ccc(NC(=O)c2ccc(cc2)-c2ccc(cc2C)-c2noc(C)n2)cc1OCCN(C)C
BDBM86708 COc1ccccc1N1CCN(CCN(C(=O)C2CCCCC2)c2ccccn2)CC1
BDBM100152 COc1ccc2c(c1)[nH]c1c(C)nccc21
BDBM50451852 NC(=O)c1ccc2[C@@H](CCN3CCC(=CC3)c3c[nH]c4c(F)cccc34)OCCc2c1 |r,c:13|
BDBM50000492 COc1cc(N)c(Cl)cc1C(=O)NC1CN2CCC1CC2 |(27.19,-33.96,;28.52,-34.73,;28.53,-36.27,;27.2,-37.04,;27.2,-38.58,;25.86,-39.35,;28.53,-39.36,;28.53,-40.89,;29.87,-38.58,;29.86,-37.03,;31.19,-36.26,;31.19,-34.72,;32.53,-37.02,;33.86,-36.25,;35.2,-37.02,;36.52,-36.25,;36.52,-34.71,;35.19,-33.94,;33.85,-34.71,;34.61,-36.04,;35.74,-34.91,)|
BDBM50003359 CCCCCCOc1nsnc1C1=CCCN(C)C1 |t:13|
BDBM50001775 [#6]-c1nc2sccn2c(=O)c1-[#6]-[#6]-[#7]-1-[#6]-[#6]\[#6](-[#6]-[#6]-1)=[#6](\c1ccc(F)cc1)-c1ccc(F)cc1
BDBM50001786 Fc1ccc(cc1)-n1cc(C2CCN(CCN3CCNC3=O)CC2)c2cc(Cl)ccc12
BDBM50001955 CN1CCc2cccc-3c2[C@H]1Cc1ccc(O)c(O)c-31 |r|
BDBM50001885 Cc1nc2CCCCn2c(=O)c1CCN1CCC(CC1)c1noc2cc(F)ccc12
BDBM50001915 Clc1cccc(c1)N1CCNCC1
BDBM50005835 CNS(=O)(=O)Cc1ccc2[nH]cc(CCN(C)C)c2c1
BDBM50007871 CN1C2CCC1CC(C2)OC(=O)c1c[nH]c2ccccc12 |THB:9:7:1:3.4|
BDBM50007406 FC(F)(F)c1cccc(c1)N1CCNCC1
BDBM50007407 C1CN(CCN1)c1cccc2ccccc12
BDBM50013515 COC(=O)[C@H]1[C@@H](O)CC[C@H]2CN3CCc4c([nH]c5ccccc45)[C@@H]3C[C@H]12 |r|
BDBM50010588 CNC(C)Cc1ccc2OCOc2c1
BDBM50454685 CN1CCN(CC1)c1cccc2ccc(OCC(=O)N3CCN(CC3)c3ccccc3C#N)cc12
BDBM50454655 COc1ccc(cc1\C=C/CN(C)C)C(=O)Nc1ccc(cc1)-c1ccncc1
BDBM50454686 CN1CCN(CC1)c1cccc2ccc(OCC(=O)N3CCN(Cc4ccccc4C)CC3)cc12
BDBM50454687 CN1CCN(CC1)c1cccc2ccc(OCC(=O)N3CCN(CC3)c3cccc4ccccc34)cc12
BDBM50014406 Cc1[nH]c2ccc(O)cc2c1CCN
BDBM50014407 C1CN(CCN1)c1ccc2ccccc2n1
BDBM50014154 Cc1nc[nH]c1Cc1nc(cs1)-c1ccccc1
BDBM50017519 CCN(CC)C(=O)N[C@H]1C[C@H]2[C@@H](Cc3c[nH]c4cccc2c34)N(C)C1
BDBM50017550 CCCNC1CCc2nc(N)sc2C1
BDBM50017520 CN(C)C1CCc2ccc3[nH]ccc3c2C1
BDBM50014945 CC(N)Cc1c[nH]c2ccc(O)cc12
BDBM50016017 CCCN1CCC[C@@H]2Cc3nc(N)ncc3C[C@@H]12
BDBM50016908 CN(C)CCCOc1ccccc1
BDBM50016909 CCCN(C)CCOc1cccc2ccccc12
BDBM50016910 CNCCCOc1ccccc1
BDBM50016911 CN(CCOc1cccc2ccccc12)Cc1ccccc1
BDBM50016912 CN(C)CCCOc1cccc2ccccc12
BDBM50016913 CCCCN(CC)CCOc1cccc2ccccc12
BDBM50016915 CCCCN(CCCC)CCOc1cccc2ccccc12
BDBM50016479 CN1C[C@H](CO)C=C2[C@H]1Cc1c[nH]c3cccc2c13 |c:6|
BDBM50016918 CN(C)CCOc1cccc2ccccc12
BDBM50016921 CN(C)CCCNc1ccccc1
BDBM50016922 CN(C)CCCCOc1cccc2ccccc12
BDBM50016927 NCCOc1cccc2ccccc12
BDBM50019443 CC(C)NCC(O)COc1cccc2[nH]ccc12
BDBM50022784 CNCCC(Oc1ccccc1C)c1ccccc1
BDBM50455552 CN(Cc1ccccc1C(F)(F)F)[C@H]1CCN(CCCc2c[nH]c3ccc(cc23)-n2cnnc2)C[C@H]1F |r|
BDBM50455553 F[C@H](CN1CCN(CCc2cccc(F)c2)CC1)Cc1c[nH]c2ccc(cc12)-n1cnnc1 |r|
BDBM50455554 F[C@H]1CN(CCCc2c[nH]c3ccc(cc23)-n2cnnc2)CC[C@@H]1NCc1ccccc1C(F)(F)F |r|
BDBM50455555 F[C@@H]1CN(CCCc2c[nH]c3ccc(cc23)-n2cnnc2)CC[C@@H]1NCc1ccccc1C(F)(F)F |r|
BDBM50455556 CN(Cc1ccccc1)[C@H]1CCN(CCCc2c[nH]c3ccc(cc23)-n2cnnc2)C[C@@H]1F |r|
BDBM50455557 CN(Cc1ccccc1C(F)(F)F)[C@H]1CCN(CCCc2c[nH]c3ccc(cc23)-n2cnnc2)C[C@@H]1F |r|
BDBM50020680 CCCN(CCC)CCc1cccc2NC(=O)Cc12
BDBM50021809 Clc1cc(I)cc(Cl)c1\[#7]=[#6]-1\[#7]-[#6]-[#6]-[#7]-1
BDBM50024204 CN(C)S(=O)(=O)N[C@H]1C[C@H]2[C@@H](Cc3cn(C)c4cccc2c34)N(C)C1
BDBM50024210 NCCc1c[nH]c2ccccc12
BDBM50028421 CCCN1C[C@H](CSC)C[C@H]2[C@H]1Cc1c[nH]c3cccc2c13
BDBM50029257 CC(C)Oc1ccccc1N1CCN(Cc2cccc(c2)C(=O)N2CCCCC2)CC1
BDBM50027065 CN1C[C@@H](C=C2[C@H]1Cc1c[nH]c3cccc2c13)C(=O)N[C@]1(C)O[C@@]2(O)[C@@H]3CCCN3C(=O)[C@H](Cc3ccccc3)N2C1=O |r,c:4|
BDBM50002642 COc1ccc(cc1OCCN1CCCCC1)N1CC=C(C1=O)c1ccc(Cl)c(Cl)c1 |c:21|
BDBM50453697 O.CCCN(CCCCN1C(=O)CC(C)(C)CC1=O)[C@H]1CCc2ccc3[nH]cc(C=O)c3c2C1 |r|
BDBM50033437 CN(C)CCc1c[nH]c2ccc(Cn3cncn3)cc12
BDBM50033383 CN(C)CCc1c[nH]c2ccc(C[C@H]3COC(=O)N3)cc12
BDBM50033442 CC(=O)Nc1ccc(cc1)N1CCN(CC1)C(=O)COc1ccc2[nH]cc(CCN)c2c1
BDBM50033447 Cc1ccccc1N1CCN(CC1)C(=O)COc1ccc2[nH]cc(CCN)c2c1
BDBM50031942 CC[C@@H](CO)NC(=O)[C@H]1CN(C)[C@@H]2Cc3cn(C)c4cccc(C2=C1)c34 |r,c:24|
BDBM50454758 CNCCOc1cccc(C)c1C
BDBM50036868 CCCN(CCCCN1C(=O)c2ccccc2S1(=O)=O)C1COc2cccc(OC)c2C1
BDBM50036844 CCCN(CCCCN1C(=O)c2ccccc2C1=O)C1COc2cccc(OC)c2C1
BDBM50035307 CCCN(CCC)[C@H]1CCc2ccc3[nH]ccc3c2C1
BDBM50035329 CCCN(CCC)C1CCc2ccc3[nH]ccc3c2C1
BDBM50035330 CCCN(CCC)[C@@H]1CCc2ccc3[nH]ccc3c2C1
BDBM50035332 CCCN(CCC)C1CCc2c(C1)ccc(F)c2N
BDBM50035356 CCCNC1CCc2ccc3[nH]cc(C=O)c3c2C1
BDBM50035301 CCCN(CCC)C1CCc2ccc3[nH]cc(CC(F)(F)F)c3c2C1
BDBM50035302 CCCN(CCC)C1CCc2ccc3[nH]cc(C(=O)C(F)(F)F)c3c2C1
BDBM50035303 CCCN(CCC)[C@@H]1CCc2ccc3[nH]cc(C=O)c3c2C1
BDBM50035348 CCCNC1CCc2ccc3[nH]ccc3c2C1
BDBM50035304 CCCN(CCC)C1CCc2cc(F)c3[nH]ccc3c2C1
BDBM50035305 CCCN(CCC)[C@H]1CCc2ccc3[nH]cc(C=O)c3c2C1
BDBM50035350 CCCN(C)C1CCc2ccc3[nH]cc(C=O)c3c2C1
BDBM50035351 CCCN(CCc1ccccc1)C1CCc2ccc3[nH]ccc3c2C1
BDBM50035352 CCCN(CCCCN1C(=O)CC(C)(C)CC1=O)C1CCc2ccc3[nH]ccc3c2C1
BDBM50035353 CCCN(CC1CC1)C1CCc2ccc3[nH]cc(C=O)c3c2C1
BDBM50035308 CCCN(CCC)C1CCc2ccc3NC(=O)Cc3c2C1
BDBM50035309 CCCN(CCC)C1CCc2ccc3[nH]cc(c3c2C1)S(C)(=O)=O
BDBM50035358 CCCN(CCCc1ccccc1OC)C1CCc2ccc3[nH]ccc3c2C1
BDBM50035359 CCCN(CCCc1ccccc1)C1CCc2ccc3[nH]cc(C=O)c3c2C1
BDBM50035360 CCCN(CCCc1ccccc1OC)C1CCc2ccc3[nH]cc(C=O)c3c2C1
BDBM50035361 C(CNCC1CCc2ccc3[nH]ccc3c2C1)Cc1ccccc1
BDBM50035310 CCCN(CCC)C1CCc2ccc3[nH]cc(C)c3c2C1
BDBM50035312 CCCNC1CCc2cc(F)ccc2C1
BDBM50035313 CCCN(CCC)C1CCc2cc(F)c3[nH]cc(C#N)c3c2C1
BDBM50035314 CCCN(CCC)C1CCc2cc(F)c3n(C)cc(C=O)c3c2C1
BDBM50035315 CCCN(CCC)[C@H]1CCc2cc(F)c3[nH]cc(C=O)c3c2C1
BDBM50035317 CCCN(CCC)[C@@H]1CCc2cc(F)c3[nH]ccc3c2C1
BDBM50035318 CCCN(CCC)C1CCc2cc(F)c3n(C)ccc3c2C1
BDBM50035319 CCCN(CCC)C1CCc2cc(F)c3[nH]cc(C=O)c3c2C1
BDBM50035320 CCCN(CCC)C1CCc2ccc3[nH]cc(C=O)c3c2C1
BDBM50035321 CCCN(CCC)C1CCc2ccc3[nH]cc(C(=O)C(N)=O)c3c2C1
BDBM50035323 CCCN(CCC)C1CCc2ccc3n(C)cc(C=O)c3c2C1
BDBM50035324 CCCN(CCC)[C@H]1CCc2ccc3[nH]cc(C#N)c3c2C1
BDBM50035325 CCCN(CCC)C1CCc2cc(F)c3[nH]cc(CCC)c3c2C1
BDBM50035326 CCCN(CCC)C1CCc2ccc3[nH]cc(C#N)c3c2C1
BDBM50035327 CCCN(CCC)[C@H]1CCc2ccc3[nH]cc(C(=O)C(N)=O)c3c2C1
BDBM50035328 CCCN(CCC)[C@@H]1CCc2ccc3[nH]cc(C#N)c3c2C1
BDBM50035363 CCCN(CCc1cccs1)C1CCc2ccc3[nH]cc(C=O)c3c2C1
BDBM50035331 CCCN(CCC)[C@@H]1CCc2ccc3[nH]cc(C(=O)C(N)=O)c3c2C1
BDBM50035333 CCCN(CCC)C1CCc2ccc3[nH]cc(C(C)=O)c3c2C1
BDBM50035336 CCCN(CCc1ccccc1)C1CCc2ccc3[nH]cc(C=O)c3c2C1
BDBM50035337 CCCN(CCCCN1C(=O)CC(C)(C)CC1=O)C1CCc2ccc3[nH]cc(C=O)c3c2C1
BDBM50035338 CCCN(Cc1ccccc1)C1CCc2ccc3[nH]cc(C=O)c3c2C1
BDBM50035341 CCCN(Cc1ccccc1)C1CCc2ccc3[nH]ccc3c2C1
BDBM50035343 CCCN(CCCOc1cccc(Cl)c1)C1CCc2ccc3[nH]cc(C=O)c3c2C1
BDBM50035344 CCCN(CCCOc1cccc(Cl)c1)C1CCc2ccc3[nH]ccc3c2C1
BDBM50035299 CCCN(CCC)[C@H]1CCc2cc(F)c3[nH]ccc3c2C1
BDBM50035347 CCCN(CC=C)C1CCc2ccc3[nH]cc(C=O)c3c2C1
BDBM50034271 FC(F)(F)c1cc(COCC2(CCNCC2)c2ccccc2)cc(c1)C(F)(F)F
BDBM50039947 CCCCCCCCCOc1ccc2[nH]cc(CCN)c2c1
BDBM50038638 Nc1ccc(CC2=NCCN2)cc1 |t:6|
BDBM50044235 CN(C)[C@H]1CCc2ccc3[nH]ccc3c2C1
BDBM50044236 CN(C)[C@@H]1CCc2ccc3[nH]ccc3c2C1
BDBM50050467 OC1(CCN(Cc2c[nH]c3ccccc23)CC1)c1ccc(Cl)cc1
BDBM50048803 Clc1cc2NC(=O)Cc2cc1CCN1CCN(CC1)c1nsc2ccccc12
BDBM50049076 CC(C)C(=O)Oc1ccc2[nH]cc(CCN(C)C)c2c1
BDBM50049077 CCCCCOc1ccc2[nH]cc(CCN)c2c1
BDBM50049078 CCCCCCCCCOc1ccc2[nH]c3CN(C)CCc3c2c1
BDBM50049079 CCC(=O)Oc1ccc2[nH]cc(CCN(C)C)c2c1
BDBM50049080 CCCCCCCCCOc1ccc2[nH]c3CCC(N)Cc3c2c1
BDBM50049081 CC(C)(C)CCCCCCCOc1ccc2[nH]cc(CCN)c2c1
BDBM50049082 CCCCCCCCOc1ccc2[nH]cc(CCN)c2c1
BDBM50049083 CCCCCCOc1ccc2[nH]c3CCC(N)Cc3c2c1
BDBM50049084 CC(C)(C)CCCCCCOc1ccc2[nH]cc(CCN)c2c1
BDBM50049085 CC(=O)c1ccc2[nH]cc(CCN)c2c1
BDBM50049086 CCc1ccc2[nH]cc(CCN)c2c1
BDBM50049087 CCCCCCCCCCOc1ccc2[nH]cc(CCN)c2c1
BDBM50049088 CCCCCCCCCOc1ccc2[nH]cc(CCNCCCC)c2c1
BDBM50049089 CCCOc1ccc2[nH]cc(CCN)c2c1
BDBM50049090 CCCCCCCCCOc1ccc2[nH]cc(CC(C)N)c2c1
BDBM50049091 CCCCCCCOc1ccc2[nH]cc(CCN)c2c1
BDBM50049092 CC(C)CCCCCCOc1ccc2[nH]cc(CCN)c2c1
BDBM50049093 CCCCCCCCC(=O)Oc1ccc2[nH]cc(CCN(C)C)c2c1
BDBM50049094 COc1ccc2[nH]c3CCC(N)Cc3c2c1
BDBM50049095 CCCCCCCCCCc1ccc2[nH]c3CCC(N)Cc3c2c1
BDBM50049096 CCCCCCCCCCCOc1ccc2[nH]cc(CCN)c2c1
BDBM50049098 COc1ccc2[nH]c3CCC(Cc3c2c1)N(C)C
BDBM50049099 CCc1ccc2[nH]cc(CCN(C)C)c2c1
BDBM50049100 NC1CCc2[nH]c3ccc(cc3c2C1)C(N)=O
BDBM50049072 CCCCCCCCCOc1ccc2[nH]cc(CCN(C)C)c2c1
BDBM50049073 CN(C)CCc1c[nH]c2ccc(OC(=O)C(C)(C)C)cc12
BDBM50049074 CCCCCCCCCCc1ccc2[nH]cc(CCN)c2c1
BDBM50049075 NCCc1c[nH]c2ccc(OCCCCC3CCCCC3)cc12
BDBM50051562 COc1ccc(cc1)N1CCN(CCC2OCCc3ccccc23)CC1
BDBM50054757 CCN(CC)CCc1c[nH]c2ccc(OS(=O)(=O)C(F)(F)F)cc12
BDBM50054760 CCCN(CCC)CCc1c[nH]c2ccc(OS(=O)(=O)C(F)(F)F)cc12
BDBM50054761 CN(C)CCc1c[nH]c2ccc(OS(=O)(=O)C(F)(F)F)cc12
BDBM50054973 NCCc1c[nH]c2ccc(OCC(=O)NCCCNC(=O)COc3ccc4[nH]cc(CCN)c4c3)cc12
BDBM50054974 NCCc1c[nH]c2ccc(OCc3ccc(COc4ccc5[nH]cc(CCN)c5c4)cc3)cc12
BDBM50054975 NCCc1c[nH]c2ccc(OCC(=O)N3CCNCC3)cc12
BDBM50054976 NCCc1c[nH]c2ccc(OCCNC(=O)COc3ccc4[nH]cc(CCN)c4c3)cc12
BDBM50054977 NCCc1c[nH]c2ccc(OCCCCCCOc3ccc4[nH]cc(CCN)c4c3)cc12
BDBM50054978 NCCc1c[nH]c2ccc(OCc3cccc(COc4ccc5[nH]cc(CCN)c5c4)c3)cc12
BDBM50054979 NCCc1c[nH]c2ccc(OCCN3CCN(CCOc4ccc5[nH]cc(CCN)c5c4)CC3)cc12
BDBM50054980 NCCc1c[nH]c2ccc(OCC(=O)N3CCC(CC3)C3CCN(CC3)C(=O)COc3ccc4[nH]cc(CCN)c4c3)cc12
BDBM50054981 NCCc1c[nH]c2ccc(OCC(=O)Nc3ccc(NC(=O)COc4ccc5[nH]cc(CCN)c5c4)cc3)cc12
BDBM50054982 NCCc1c[nH]c2ccc(OCCOc3ccc4[nH]cc(CCN)c4c3)cc12
BDBM50054983 NCCc1c[nH]c2ccc(OCCNC(=O)NCCOc3ccc4[nH]cc(CCN)c4c3)cc12
BDBM50054984 NCCc1c[nH]c2ccc(OCc3ccccc3COc3ccc4[nH]cc(CCN)c4c3)cc12
BDBM50054985 NCCc1c[nH]c2ccc(OCCCCCCNS(=O)(=O)c3ccc(cc3)-c3ccc(cc3)S(=O)(=O)NCCCCCCOc3ccc4[nH]cc(CCN)c4c3)cc12
BDBM50054762 NCCc1c[nH]c2ccc(OS(=O)(=O)C(F)(F)F)cc12
BDBM50054764 COc1ccc(CNC(=O)\C=C\c2ccc3[nH]cc(CCN(C)C)c3c2)cc1
BDBM50054986 NCCc1c[nH]c2ccc(OCC(=O)N3CCN(CC3)C(=O)COc3ccc4[nH]cc(CCN)c4c3)cc12
BDBM50054987 NCCc1c[nH]c2ccc(OCCN3CCN(CC3)C(=O)COc3ccc4[nH]cc(CCN)c4c3)cc12
BDBM50054988 NCCc1c[nH]c2ccc(OCC(=O)Nc3ccc(cc3)N3CCN(CC3)C(=O)COc3ccc4[nH]cc(CCN)c4c3)cc12
BDBM50054143 COc1cccc2OCC3(CCCN3CCCCN3C(=O)CC4(CCCC4)CC3=O)Cc12
BDBM50061296 COc1cccc(N2CCN(CC2)C(=O)COc2ccc3cccc(N4CCN(C)CC4)c3c2)c1OC
BDBM50061962 CC(C)NCCCOc1cccc2[nH]ccc12
BDBM50061963 CCNCCOc1cccc2ccccc12
BDBM50061964 OCCNCCOc1cccc2ccccc12
BDBM50061297 CN1CCN(CC1)c1cccc2ccc(OCC(=O)N3CCN(CC3)c3cccc4OCCOc34)cc12
BDBM50061299 CN1CCN(CC1)c1cccc2ccc(OCC(=O)N3CCN(CC3)c3ccccc3C)cc12
BDBM50061966 CC(C)NCCCOc1cccc2ccccc12
BDBM50061967 CC(C)NCCOc1cccc2ccccc12
BDBM50061968 CCCN(C)CCOc1ccccc1C1CCCC1
BDBM50061300 COc1ccc2ccc(cc2c1)N1CCNCC1
BDBM50061303 COc1ccc(NC(=O)c2ccc(cc2)-c2ccc(cc2C)C2=NOC(C)N2)cc1N1CCN(C)CC1 |t:24|
BDBM50061304 CN1CCN(CC1)c1cccc2ccc(OCC(=O)N3CCN(CC3)c3c(C)cc(C)cc3C)cc12
BDBM50061969 CNCCOc1ccccc1
BDBM50061970 CCCN(C)CCCOc1ccccc1C1CCCC1
BDBM50061971 CNCCOc1cccc2ccccc12
BDBM50061972 NCCCOc1cccc2ccccc12
BDBM50061973 CC(C)NCCOc1cccc2[nH]ccc12
BDBM50061974 CCCNCCOc1cccc2ccccc12
BDBM50060427 CN(C[C@@H]1CCN(CCc2c[nH]c3ccc(cc23)-n2cnnc2)C1)Cc1ccccc1
BDBM50060428 OC[C@H](NC1CCN(CCCc2c[nH]c3ccc(cc23)-n2cnnc2)CC1)c1ccccc1
BDBM50060429 OC[C@H](NC1CCN(CCCc2c[nH]c3ccc(cc23)-n2cnnc2)CC1)c1ccc(F)cc1
BDBM50060430 C[C@@H](NC1CCN(CCCc2c[nH]c3ccc(cc23)-n2cnnc2)CC1)c1ccccc1
BDBM50060431 C(CN1CCCCC1)Cc1c[nH]c2ccc(cc12)-n1cnnc1
BDBM50060432 CN(Cc1ccccc1)[C@@H]1CCN(CCc2c[nH]c3ccc(cc23)-n2cnnc2)C1
BDBM50060433 C(Cc1c[nH]c2ccc(cc12)-n1cnnc1)N1CCCCC1
BDBM50060434 Fc1ccc(CCN2CCN(CCCc3c[nH]c4ccc(cc34)-n3cnnc3)CC2)cc1F
BDBM50060435 CN1CCN(CCCc2c[nH]c3ccc(cc23)-n2cnnc2)CC1
BDBM50060436 Fc1ccccc1CCN1CCN(CCCc2c[nH]c3ccc(cc23)-n2cnnc2)CC1
BDBM50060437 Fc1cccc(CCN2CCN(CCCc3c[nH]c4ccc(cc34)-n3cnnc3)CC2)c1
BDBM50060438 CC(=O)Nc1ccc(CCN2CCN(CCCc3c[nH]c4ccc(cc34)-n3cnnc3)CC2)cc1
BDBM50060439 Fc1cc(F)cc(CCN2CCN(CCCc3c[nH]c4ccc(cc34)-n3cnnc3)CC2)c1
BDBM50060440 C(CN1CCN(Cc2ccccc2)CC1)Cc1c[nH]c2ccc(cc12)-n1cnnc1
BDBM50060441 CN1CCN(CCc2c[nH]c3ccc(cc23)-n2cnnc2)CC1
BDBM50060442 CC(=O)Nc1cccc(CCN2CCN(CCCc3c[nH]c4ccc(cc34)-n3cnnc3)CC2)c1
BDBM50060443 Fc1ccc(CCN2CCN(CCCc3c[nH]c4ccc(cc34)-n3cnnc3)CC2)cc1
BDBM50060444 C(CN1CCN(CCc2ccccc2)CC1)Cc1c[nH]c2ccc(cc12)-n1cnnc1
BDBM50060516 COc1ccc(cc1\C=C\CN(C)C)C(=O)Nc1ccc(cc1)-c1ccncc1
BDBM50060517 COc1ccc(cc1C#CCN(C)C)C(=O)Nc1ccc(cc1)-c1ccncc1
BDBM50060518 COc1ccc(cc1CCCN(C)C)C(=O)Nc1ccc(cc1)-c1ccncc1
BDBM50060519 CN(C)CCCc1cc(ccc1O)C(=O)Nc1ccc(cc1)-c1ccncc1
BDBM50060426 CN(C)CCc1c[nH]c2ccc(cc12)-n1cnnc1
BDBM50060419 C(Cc1c[nH]c2ccc(cc12)-n1cnnc1)N1CCCC1
BDBM50060420 C(Cc1c[nH]c2ccc(cc12)-n1cnnc1)N1CC[C@@H](COCc2ccccc2)C1
BDBM50060421 C(CN1CCC(CC1)NCc1ccccc1)Cc1c[nH]c2ccc(cc12)-n1cnnc1
BDBM50060422 CN(CC1CCN(CCCc2c[nH]c3ccc(cc23)-n2cnnc2)CC1)Cc1ccccc1
BDBM50060423 CN(Cc1ccccc1)C1CCN(CCCc2c[nH]c3ccc(cc23)-n2cnnc2)CC1
BDBM50060424 C(Cc1c[nH]c2ccc(cc12)-n1cnnc1)N1CC[C@H](C1)OCc1ccccc1
BDBM50060425 C(Cc1c[nH]c2ccc(cc12)-n1cnnc1)N1CC[C@@H](CNCc2ccccc2)C1
BDBM50064812 Cc1ccc(CC2=NCCN2)c(C)c1OCc1ccccc1 |t:6|
BDBM50064813 CC(C)(C)c1ccc(CC2=NCCN2)cc1 |t:9|
BDBM50064814 Brc1ccc(CC2=NCCN2)cc1 |t:6|
BDBM50064815 Cc1ccc(O)c(C)c1CC1=NCCN1 |t:11|
BDBM50064816 Cc1cc(ccc1CC1=NCCN1)C(C)(C)C |t:9|
BDBM50064817 Cc1cccc(C)c1CC1=NCCN1 |t:10|
BDBM50064818 Cc1cc(cc(C)c1CC(N)=N)C(C)(C)C
BDBM50064819 CCc1ccc(CC2=NCCN2)cc1 |t:7|
BDBM50064820 Cc1cc(C)c(CC2=NCCN2)c(C)c1 |t:7|
BDBM50064821 CCCCc1ccc(CC2=NCCN2)cc1 |t:9|
BDBM50064822 Cc1cc(cc(C)c1CCN)C(C)(C)C
BDBM50064823 CCCc1ccc(CC2=NCCN2)cc1 |t:8|
BDBM50064824 COc1cccc(CC2=NCCN2)c1 |t:8|
BDBM50064825 CN1CCN=C1Cc1ccccc1 |c:4|
BDBM50064826 CNCCc1c(C)cc(cc1C)C(C)(C)C
BDBM50064783 COc1ccc(cc1)N1CCN(CC[C@H]2OCCc3cc(ccc23)C(N)=O)CC1
BDBM50064784 COc1ccc(cc1)N1CCN(CC[C@@H]2OCCc3cc(ccc23)C(N)=O)CC1
BDBM50064785 COc1ccc(cc1)N1CCN(CCC2OCCc3cc(ccc23)C(N)=O)CC1
BDBM50064786 CNC(=O)c1ccc2[C@H](CCN3CCN(CC3)c3ccc(OC)cc3)OCCc2c1 |r|
BDBM50064787 CNC(=O)c1ccc2[C@@H](CCN3CCN(CC3)c3ccc(OC)cc3)OCCc2c1
BDBM50065416 CN(Cc1ccccc1)C1CCN(CC(F)Cc2c[nH]c3ccc(cc23)-n2cnnc2)CC1
BDBM50065417 FC1(Cc2ccccc2)CCN(CCCc2c[nH]c3ccc(cc23)-n2cnnc2)CC1
BDBM50065418 FC(CN1CCC(Cc2ccccc2)CC1)Cc1c[nH]c2ccc(cc12)-n1cnnc1
BDBM50065419 C(CN1CCC(Cc2ccccc2)CC1)Cc1c[nH]c2ccc(cc12)-n1cnnc1
BDBM50065420 FC(CN1CCN(CCc2cccc(F)c2)CC1)Cc1c[nH]c2ccc(cc12)-n1cnnc1
BDBM50065421 Fc1cccc(CCC2(F)CCN(CCCc3c[nH]c4ccc(cc34)-n3cnnc3)CC2)c1
BDBM50065423 CN(Cc1ccccc1)[C@H]1CCN(CCCc2c[nH]c3ccc(cc23)-n2cnnc2)C[C@H]1F
BDBM50064804 Cc1ccc(CC2=NCCN2)c(C)c1O |t:6|
BDBM50064805 CC(C)c1ccc(CC2=NCCN2)cc1 |t:8|
BDBM50064806 CC(C)c1cc(C)c(CC2=NCCN2)c(C)c1 |t:9|
BDBM50064807 C(C1=NCCN1)c1ccc(cc1)-c1ccccc1 |t:1|
BDBM50064808 Cc1cc(Br)cc(C)c1CC1=NCCN1 |t:11|
BDBM50064809 Oc1cccc(CC2=NCCN2)c1 |t:7|
BDBM50064810 CN1CCN=C1Cc1c(C)cc(cc1C)C(C)(C)C |c:4|
BDBM50064811 [O-][N+](=O)c1ccc(CC2=[NH+]CC[N-]2)cc1 |t:8|
BDBM50070405 CN1CCN(CC1)c1cccc2ccc(OCCOc3ccc4cccc(N5CCN(C)CC5)c4c3)cc12
BDBM50070406 CN1CCN(CC1)c1cccc2ccc(OCC(=O)Nc3ccc(NC(=O)COc4ccc5[nH]cc(CCN)c5c4)cc3)cc12
BDBM50070407 CCCN(CCC)C1CCc2cccc(OCCCCCCOc3cccc4CCC(Cc34)N(CCC)CCC)c2C1
BDBM50070408 CN1CCN(CC1)c1cccc2ccc(OCC(=O)N3CCN(CC3)C(=O)COc3ccc4cccc(N5CCN(C)CC5)c4c3)cc12
BDBM50070409 CN1CCN(CC1)c1cccc2ccc(OCCOc3ccc4[nH]cc(CCN)c4c3)cc12
BDBM50068818 CNC(=O)C1C(C(C(=O)NCCCN2CCC(CC2)(C(=O)OC)c2ccccc2)=C(C)N=C1C)c1ccc(cc1)[N+]([O-])=O |c:33,t:30|
BDBM50069315 CN(C)CCc1c[nH]c2ccc(CS(=O)(=O)N(C)Cc3ccc(CN(C)S(=O)(=O)Cc4ccc5[nH]cc(CCN(C)C)c5c4)cc3)cc12
BDBM50073682 CNS(=O)(=O)CCc1ccc2[nH]cc(C3CCN(C)CC3)c2c1
BDBM50073688 CNCCc1c[nH]c2ccc(cc12)C(C)(C)C
BDBM50073689 CN[C@@H]1CCc2[nH]c3ccc(cc3c2C1)C(N)=O
BDBM50075360 COc1ccc(cc1)N1CCN(Cc2c[nH]c3ncccc23)CC1
BDBM50074147 CC(=O)N(C[C@@H]1CCN(CCc2c[nH]c3ccc(cc23)-n2cnnc2)C1)Cc1ccccc1
BDBM50074148 C(Cc1c[nH]c2ccc(cc12)-n1cnnc1)N1CC[C@@H](CNCc2ccccn2)C1
BDBM50074149 C[C@H](N(C)C[C@@H]1CCN(CCc2c[nH]c3ccc(Cn4cncn4)cc23)C1)c1ccccc1
BDBM50074150 CN(C[C@@H]1CCN(CCCc2c[nH]c3ccc(cc23)-n2cnnc2)C1)Cc1ccccc1
BDBM50074151 C(Cc1c[nH]c2ccc(cc12)-n1cnnc1)N1CC[C@H](CNCc2ccccc2)C1
BDBM50074152 C(Cc1c[nH]c2ccc(Cn3cncn3)cc12)N1CC[C@@H](CNCc2ccccc2)C1
BDBM50074153 CN(C[C@@H]1CCN(CCc2c[nH]c3ccc(Cn4cncn4)cc23)C1)Cc1ccccc1
BDBM50074154 CN(C[C@@H]1CCCN1CCc1c[nH]c2ccc(cc12)-n1cnnc1)Cc1ccccc1
BDBM50074155 C[C@H](NC[C@@H]1CCN(CCc2c[nH]c3ccc(Cn4cncn4)cc23)C1)c1ccccc1
BDBM50074156 CNS(=O)(=O)Cc1ccc2[nH]cc(CCN3CC[C@@H](CNCc4ccccc4)C3)c2c1
BDBM50074157 C(CN1CC[C@@H](COCc2ccccc2)C1)Cc1c[nH]c2ccc(cc12)-n1cnnc1
BDBM50074158 OC[C@@H]1CCN(CCc2c[nH]c3ccc(cc23)-n2cnnc2)C1
BDBM50074159 C[C@H](NC[C@@H]1CCN(CCc2c[nH]c3ccc(C[C@H]4COC(=O)N4)cc23)C1)c1ccccc1
BDBM50074160 OC[C@@H](NC[C@@H]1CCN(CCc2c[nH]c3ccc(cc23)-n2cnnc2)C1)c1ccccc1
BDBM50074161 C(Cc1c[nH]c2ccc(cc12)-n1cnnc1)N1CC[C@@H](CNc2ccccc2)C1
BDBM50074162 CN(C[C@@H]1CCN(CCc2c[nH]c3ccc(C[C@H]4COC(=O)N4C)cc23)C1)Cc1ccccc1
BDBM50074164 C[C@H](NC[C@@H]1CCN(CCc2c[nH]c3ccc(cc23)-n2cnnc2)C1)c1ccccc1
BDBM50074165 C(Cc1c[nH]c2ccc(cc12)-n1cnnc1)N1CCC[C@H]1COCc1ccccc1
BDBM50074166 CC(=O)Nc1ccc(CNC[C@@H]2CCN(CCc3c[nH]c4ccc(cc34)-n3cnnc3)C2)cc1
BDBM50074167 C(Cc1ccccc1)NC[C@@H]1CCN(CCc2c[nH]c3ccc(cc23)-n2cnnc2)C1
BDBM50074168 OC[C@H](NC[C@@H]1CCN(CCc2c[nH]c3ccc(cc23)-n2cnnc2)C1)c1ccccc1
BDBM50074169 C=CCNC[C@@H]1CCN(CCc2c[nH]c3ccc(cc23)-n2cnnc2)C1
BDBM50074170 C(Cc1c[nH]c2ccc(cc12)-n1cnnc1)N1CC[C@@H](CNCc2ccncc2)C1
BDBM50074171 O=C1N[C@@H](Cc2ccc3[nH]cc(CCN4CC[C@@H](CNCc5ccccc5)C4)c3c2)CO1
BDBM50074172 C[C@@H](NC[C@@H]1CCN(CCc2c[nH]c3ccc(cc23)-n2cnnc2)C1)c1ccccc1
BDBM50074173 C(Cc1c[nH]c2ccc(cc12)-n1cnnc1)N1CC[C@@H](CNCc2ccco2)C1
BDBM50074174 C(Cc1c[nH]c2ccc(cc12)-n1cnnc1)N1CC[C@@H](C1)OCc1ccccc1
BDBM50074175 O[C@@H]1CCN(CCc2c[nH]c3ccc(cc23)-n2cnnc2)C1
BDBM50074176 C(Cc1c[nH]c2ccc(cc12)-n1cnnc1)N1CC[C@@H](CNCc2cccnc2)C1
BDBM50074177 C(Cc1c[nH]c2ccc(cc12)-n1cnnc1)N1CC[C@@H](CNCc2ccoc2)C1
BDBM50074178 CC(C)(NC[C@@H]1CCN(CCc2c[nH]c3ccc(cc23)-n2cnnc2)C1)c1ccccc1
BDBM50074179 C(Cc1c[nH]c2ccc(cc12)-n1cnnc1)N1CCC[C@@H]1COCc1ccccc1
BDBM50074180 CN(C)C(=O)C(N1CCN(CCCc2c[nH]c3ccc(cc23)-n2cnnc2)CC1)c1ccccc1
BDBM50074181 N#Cc1ccc(CN2CCN(CCCc3c[nH]c4ccc(cc34)-n3cnnc3)CC2)cc1
BDBM50074182 S=C1CN(CCCc2c[nH]c3ccc(cc23)-n2cnnc2)CCN1Cc1ccccc1
BDBM50074183 O=C1CN(CCCc2c[nH]c3ccc(cc23)-n2cnnc2)CCN1Cc1ccccc1
BDBM50074184 CNCC(N1CCN(CCCc2c[nH]c3ccc(cc23)-n2cnnc2)CC1)c1ccccc1
BDBM50074185 O=C1CN(Cc2ccccc2)CCN1CCCc1c[nH]c2ccc(cc12)-n1cnnc1
BDBM50074186 Fc1ccc(CN2CCN(CCCc3c[nH]c4ccc(cc34)-n3cnnc3)CC2)cc1
BDBM50074187 Clc1ccc(CN2CCN(CCCc3c[nH]c4ccc(cc34)-n3cnnc3)CC2)cc1
BDBM50074188 NC(=O)C(N1CCN(CCCc2c[nH]c3ccc(cc23)-n2cnnc2)CC1)c1ccccc1
BDBM50074189 C(CN1CCN(Cc2ccncc2)CC1)Cc1c[nH]c2ccc(cc12)-n1cnnc1
BDBM50074190 CC(=O)Nc1ccc(CN2CCN(CCCc3c[nH]c4ccc(cc34)-n3cnnc3)CC2)cc1
BDBM50074191 C(CN1CCNCC1)Cc1c[nH]c2ccc(cc12)-n1cnnc1
BDBM50074192 C(CN1CCN(CC1)c1ccccc1)Cc1c[nH]c2ccc(cc12)-n1cnnc1
BDBM50074193 C(CN1CCN(CCc2cccnc2)CC1)Cc1c[nH]c2ccc(cc12)-n1cnnc1
BDBM50074194 OCC(N1CCN(CCCc2c[nH]c3ccc(cc23)-n2cnnc2)CC1)c1ccccc1
BDBM50074195 C(CN1CCOCC1)Cc1c[nH]c2ccc(cc12)-n1cnnc1
BDBM50074196 FC(F)(F)c1ccc(CN2CCN(CCCc3c[nH]c4ccc(cc34)-n3cnnc3)CC2)cc1
BDBM50074197 CN1CCN(CCCCc2c[nH]c3ccc(cc23)-n2cnnc2)CC1
BDBM50074198 C(CN1CCN(Cc2ccccn2)CC1)Cc1c[nH]c2ccc(cc12)-n1cnnc1
BDBM50074199 CC(N1CCN(CCCc2c[nH]c3ccc(cc23)-n2cnnc2)CC1)c1ccccc1
BDBM50074200 C(CN1CCN(CC1)c1ncccn1)Cc1c[nH]c2ccc(cc12)-n1cnnc1
BDBM50074201 C(CN1CCN(Cc2ccco2)CC1)Cc1c[nH]c2ccc(cc12)-n1cnnc1
BDBM50074202 CC(CN1CCN(CCCc2c[nH]c3ccc(cc23)-n2cnnc2)CC1)c1ccccc1
BDBM50074203 C(CN1CCN(Cc2ccoc2)CC1)Cc1c[nH]c2ccc(cc12)-n1cnnc1
BDBM50074204 C(CN1CCN(Cc2ncc[nH]2)CC1)Cc1c[nH]c2ccc(cc12)-n1cnnc1
BDBM50074205 CC(=O)Nc1cccc(CN2CCN(CCCc3c[nH]c4ccc(cc34)-n3cnnc3)CC2)c1
BDBM50074206 C(CN1CCN(Cc2cccnc2)CC1)Cc1c[nH]c2ccc(cc12)-n1cnnc1
BDBM50074207 Cc1noc(n1)-c1ccc(CCN2CCN(CCCc3c[nH]c4ccc(cc34)-n3cnnc3)CC2)cc1
BDBM50074208 C(CN1CCN(CCCc2ccccc2)CC1)Cc1c[nH]c2ccc(cc12)-n1cnnc1
BDBM50074209 O=C1CN(CCCc2c[nH]c3ccc(cc23)-n2cnnc2)CCN1CCc1ccccc1
BDBM50074163 C(Cc1c[nH]c2ccc(cc12)-n1cnnc1)N1CCC1
BDBM50077806 CC(CC1(F)CCN(CCCc2c[nH]c3ccc(cc23)-n2cnnc2)CC1)c1ccccc1
BDBM50077807 Fc1ccccc1CC1(F)CCN(CCCc2c[nH]c3ccc(cc23)-n2cnnc2)CC1
BDBM50077808 Fc1ccc(CCC2(F)CCN(CCCc3c[nH]c4ccc(cc34)-n3cnnc3)CC2)cc1
BDBM50077809 FC(CN1CCN(CCc2ccccc2F)CC1)Cc1c[nH]c2ccc(cc12)-n1cnnc1
BDBM50077811 FC(CN1CCN(CCc2ccccc2)CC1)Cc1c[nH]c2ccc(cc12)-n1cnnc1
BDBM50077812 CC(CN1CCN(CC(F)Cc2c[nH]c3ccc(cc23)-n2cnnc2)CC1)c1ccc(F)cc1
BDBM50077814 FC(F)(F)c1ccccc1CC1(F)CCN(CCCc2c[nH]c3ccc(cc23)-n2cnnc2)CC1
BDBM50077816 FC(CN1CCC(CC1)OCc1ccccc1)Cc1c[nH]c2ccc(cc12)-n1cnnc1
BDBM50077817 CC(CN1CCN(CC(F)(F)Cc2c[nH]c3ccc(cc23)-n2cnnc2)CC1)c1ccccc1
BDBM50077818 FC(F)(CN1CCC(CCc2ccccc2)CC1)Cc1c[nH]c2ccc(cc12)-n1cnnc1
BDBM50077819 FC(F)(CN1CCC(CC1)OCc1ccccc1)Cc1c[nH]c2ccc(cc12)-n1cnnc1
BDBM50077820 Fc1ccccc1CCC1(F)CCN(CCCc2c[nH]c3ccc(cc23)-n2cnnc2)CC1
BDBM50077821 Fc1cccc(CCN2CCN(CC(F)(F)Cc3c[nH]c4ccc(cc34)-n3cnnc3)CC2)c1
BDBM50077822 FC(F)(CN1CCC(COc2ccccc2)CC1)Cc1c[nH]c2ccc(cc12)-n1cnnc1
BDBM50077823 FC(CN1CCN(CCc2ccc(F)cc2)CC1)Cc1c[nH]c2ccc(cc12)-n1cnnc1
BDBM50077824 FC1(CCc2ccccc2)CCN(CCCc2c[nH]c3ccc(cc23)-n2cnnc2)CC1
BDBM50077825 CC(CN1CCN(CC(F)Cc2c[nH]c3ccc(cc23)-n2cnnc2)CC1)c1cccc(F)c1
BDBM50077826 CC(CN1CCN(CC(F)(F)Cc2c[nH]c3ccc(cc23)-n2cnnc2)CC1)c1ccc(F)cc1
BDBM50077827 CC(CN1CCN(CC(F)Cc2c[nH]c3ccc(cc23)-n2cnnc2)CC1)c1ccccc1F
BDBM50077828 OC(CN1CCN(Cc2ccccc2)CC1)Cc1c[nH]c2ccc(cc12)-n1cnnc1
BDBM50077829 FC(F)(CN1CCC(Cc2ccccc2)CC1)Cc1c[nH]c2ccc(cc12)-n1cnnc1
BDBM50077830 Fc1cccc(CC2(F)CCN(CCCc3c[nH]c4ccc(cc34)-n3cnnc3)CC2)c1
BDBM50077831 CN(Cc1ccccc1)C1CCN(CC(F)(F)Cc2c[nH]c3ccc(cc23)-n2cnnc2)CC1
BDBM50081702 COc1ccc2[nH]cc(C[C@@H]3CCCN3C)c2c1
BDBM50081704 COc1ccc2[nH]cc(C[C@H]3CCCN3C)c2c1
BDBM50083653 CN(CC1CC1)CC1(O)CCN(CCCc2c[nH]c3ccc(cc23)-n2cnnc2)CC1
BDBM50083654 CC(C)(C)CNCC1(O)CCN(CCCc2c[nH]c3ccc(cc23)-n2cnnc2)CC1
BDBM50083655 CN(CC1CCCCC1)CC1(O)CCN(CCCc2c[nH]c3ccc(cc23)-n2cnnc2)CC1
BDBM50083656 CC(C)(C)OC(=O)NCC1(O)CCN(CCCc2c[nH]c3ccc(cc23)-n2cnnc2)CC1
BDBM50083657 CN(CC(C)(C)C)CC1(O)CCN(CCCc2c[nH]c3ccc(cc23)-n2cnnc2)CC1
BDBM50083658 OC1(Cc2ccccc2)CCN(CCCc2c[nH]c3ccc(cc23)-n2cnnc2)CC1
BDBM50083659 CC(C)CN(C)CC1(O)CCN(CCCc2c[nH]c3ccc(cc23)-n2cnnc2)CC1
BDBM50083660 CN(Cc1ccccc1)CC1(O)CCN(CCCc2c[nH]c3ccc(cc23)-n2cnnc2)CC1
BDBM50083661 CC(=O)Nc1ccc(CNCC2(O)CCN(CCCc3c[nH]c4ccc(cc34)-n3cnnc3)CC2)cc1
BDBM50083662 CC1(C)CCCN(CC2(O)CCN(CCCc3c[nH]c4ccc(cc34)-n3cnnc3)CC2)C1
BDBM50083663 OC1(CNCC2CC2)CCN(CCCc2c[nH]c3ccc(cc23)-n2cnnc2)CC1
BDBM50083664 OC1(CNCc2ccccn2)CCN(CCCc2c[nH]c3ccc(cc23)-n2cnnc2)CC1
BDBM50083665 OC1(CNCc2ccccc2)CCN(CCCc2c[nH]c3ccc(cc23)-n2cnnc2)CC1
BDBM50083666 Cc1ccccc1CNCC1(O)CCN(CCCc2c[nH]c3ccc(cc23)-n2cnnc2)CC1
BDBM50083667 CN(Cc1ccccc1C)CC1(O)CCN(CCCc2c[nH]c3ccc(cc23)-n2cnnc2)CC1
BDBM50084959 CN1CCC2(COc3cc4CCN(C(=O)c5ccc(cc5)-c5ccc(cc5C)-c5noc(C)n5)c4cc23)CC1
BDBM50083082 C[C@@H](O)[C@H](NC1CCN(CCCc2c[nH]c3ccc(cc23)-n2cnnc2)CC1)c1ccccc1
BDBM50083083 COC[C@H](NC1CCN(CCCc2c[nH]c3ccc(cc23)-n2cnnc2)CC1)c1ccccc1
BDBM50083084 C[C@@H](NC1CCN(CCCc2c[nH]c3ccc(cc23)-n2cncn2)CC1)c1ccccc1
BDBM50083085 C[C@@H](NC1CCN(CCCc2c[nH]c3ccc(cc23)-n2cnnc2)CC1)[C@H](O)c1ccccc1
BDBM50083086 CN(Cc1ccc(NC(C)=O)cc1)C1CCN(CCCc2c[nH]c3ccc(cc23)-n2cnnc2)CC1
BDBM50083087 CC#CCN(C)C1CCN(CCCc2c[nH]c3ccc(cc23)-n2cnnc2)CC1
BDBM50083088 OC[C@H](NC1CCN(CCCc2c[nH]c3ccc(C[C@H]4COC(=O)N4)cc23)CC1)c1ccccc1
BDBM50083089 CN(Cc1cccs1)C1CCN(CCCc2c[nH]c3ccc(cc23)-n2cnnc2)CC1
BDBM50083090 CN(C)C[C@H](NC1CCN(CCCc2c[nH]c3ccc(cc23)-n2cnnc2)CC1)c1ccccc1
BDBM50083091 CN(C1CCN(CCCc2c[nH]c3ccc(cc23)-n2cnnc2)CC1)S(=O)(=O)c1ccccc1
BDBM50083092 C[C@H](O)[C@H](NC1CCN(CCCc2c[nH]c3ccc(cc23)-n2cnnc2)CC1)c1ccccc1
BDBM50083093 CN(CCc1ccc(NC(C)=O)cc1)C1CCN(CCCc2c[nH]c3ccc(cc23)-n2cnnc2)CC1
BDBM50083094 OCCC(NC1CCN(CCCc2c[nH]c3ccc(cc23)-n2cnnc2)CC1)c1ccccc1
BDBM50083095 C[C@@H](NC1CCN(CCCc2c[nH]c3ccc(cc23)-n2cnnc2)CC1)c1ccc(NC(C)=O)cc1
BDBM50083096 CN(CCC=C(C)C)C1CCN(CCCc2c[nH]c3ccc(cc23)-n2cnnc2)CC1 |(15.54,-6.09,;14.49,-4.94,;14.97,-3.47,;16.48,-3.15,;16.95,-1.68,;18.45,-1.36,;18.91,.1,;19.49,-2.5,;13.01,-5.26,;12.53,-6.73,;11.03,-7.06,;10.01,-5.91,;8.5,-6.25,;8.04,-7.72,;6.54,-8.04,;6.07,-9.51,;6.99,-10.74,;6.09,-12.02,;4.61,-11.54,;3.27,-12.31,;1.93,-11.54,;1.93,-10.01,;3.27,-9.24,;4.59,-10.01,;.61,-9.24,;.45,-7.7,;-1.06,-7.38,;-1.83,-8.72,;-.79,-9.87,;10.45,-4.45,;11.96,-4.13,)|
BDBM50083097 NC(=O)OC[C@H](NC1CCN(CCCc2c[nH]c3ccc(cc23)-n2cnnc2)CC1)c1ccccc1
BDBM50083098 CN(CC1CCN(CCCc2c[nH]c3ccc(cc23)-n2cnnc2)CC1)C(=O)c1ccc(NC(C)=O)cc1
BDBM50083099 NC1CCN(CCCc2c[nH]c3ccc(cc23)-n2cnnc2)CC1
BDBM50083100 C[C@@H](NC1CCN(CCCc2c[nH]c3ccc(cc23)-n2cnnc2)CC1)[C@@H](O)c1ccccc1
BDBM50083101 OC[C@@H](Cc1ccccc1)NC1CCN(CCCc2c[nH]c3ccc(cc23)-n2cnnc2)CC1
BDBM50083102 OC[C@@H](NCC1CCN(CCCc2c[nH]c3ccc(cc23)-n2cnnc2)CC1)c1ccccc1
BDBM50083103 CS(=O)(=O)NC[C@H](NC1CCN(CCCc2c[nH]c3ccc(cc23)-n2cnnc2)CC1)c1ccccc1
BDBM50083104 COC[C@H](NC1CCN(CCCc2c[nH]c3ccc(cc23)-n2cnnc2)CC1)c1ccc(F)cc1
BDBM50083105 C(CN1CCC(CNc2ccccn2)CC1)Cc1c[nH]c2ccc(cc12)-n1cnnc1
BDBM50083106 CC(CO)(NC1CCN(CCCc2c[nH]c3ccc(cc23)-n2cnnc2)CC1)c1ccccc1
BDBM50083107 CNS(=O)(=O)Cc1ccc2[nH]cc(CCCN3CCC(CC3)N[C@H](C)c3ccccc3)c2c1
BDBM50083108 C[C@H](NCC1CCN(CCCc2c[nH]c3ccc(cc23)-n2cnnc2)CC1)c1ccc(NC(C)=O)cc1
BDBM50083109 C(CN1CCC(CC1)NCc1ccccn1)Cc1c[nH]c2ccc(cc12)-n1cnnc1
BDBM50083110 CN(Cc1ccsc1)C1CCN(CCCc2c[nH]c3ccc(cc23)-n2cnnc2)CC1
BDBM50083111 C[C@@H](NCC1CCN(CCCc2c[nH]c3ccc(cc23)-n2cnnc2)CC1)c1ccc(NC(C)=O)cc1
BDBM50083112 C[C@@H](NCC1CCN(CCCc2c[nH]c3ccc(cc23)-n2cnnc2)CC1)c1ccccc1
BDBM50083113 CN(CC1CCN(CCCc2c[nH]c3ccc(cc23)-n2cnnc2)CC1)Cc1ccc(NC(C)=O)cc1
BDBM50083114 C[C@H](Cc1ccccc1)NC1CCN(CCCc2c[nH]c3ccc(cc23)-n2cnnc2)CC1
BDBM50083115 C[C@@H](NC1CCN(CCCc2c[nH]c3ccc(cc23)-n2ccnc2)CC1)c1ccccc1
BDBM50083116 OC[C@H](Cc1ccccc1)NC1CCN(CCCc2c[nH]c3ccc(cc23)-n2cnnc2)CC1
BDBM50083117 CN(Cc1ccco1)C1CCN(CCCc2c[nH]c3ccc(cc23)-n2cnnc2)CC1
BDBM50083118 C(CN1CCC(CNCc2ccccc2)CC1)Cc1c[nH]c2ccc(cc12)-n1cnnc1
BDBM50083119 OC[C@H](NC1CCN(CCCc2c[nH]c3ccc(Cn4cncn4)cc23)CC1)c1ccccc1
BDBM50083120 CN(CC=C(C)C)C1CCN(CCCc2c[nH]c3ccc(cc23)-n2cnnc2)CC1 |(18.82,-5.86,;17.8,-4.72,;18.27,-3.25,;19.77,-2.93,;20.23,-1.45,;21.74,-1.13,;19.21,-.32,;16.29,-5.04,;15.81,-6.5,;14.32,-6.84,;13.3,-5.68,;11.79,-6.02,;11.32,-7.5,;9.82,-7.82,;9.37,-9.29,;10.29,-10.54,;9.37,-11.8,;7.89,-11.32,;6.55,-12.09,;5.23,-11.32,;5.23,-9.78,;6.55,-9.02,;7.89,-9.78,;3.89,-9.02,;3.73,-7.48,;2.22,-7.16,;1.45,-8.5,;2.5,-9.65,;13.75,-4.23,;15.26,-3.91,)|
BDBM50083121 OC[C@H](NC1CCN(CCCc2c[nH]c3ccc(cc23)-n2cncn2)CC1)c1ccccc1
BDBM50083122 CN(C1CCN(CCCc2c[nH]c3ccc(cc23)-n2cnnc2)CC1)C(=O)Nc1ccccc1
BDBM50083123 O[C@H]1Cc2ccccc2C1NC1CCN(CCCc2c[nH]c3ccc(cc23)-n2cnnc2)CC1
BDBM50083124 CN(CC1CC1)C1CCN(CCCc2c[nH]c3ccc(cc23)-n2cnnc2)CC1
BDBM50083125 CC(=O)Nc1ccc(CCNC2CCN(CCCc3c[nH]c4ccc(cc34)-n3cnnc3)CC2)cc1
BDBM50083126 CN([C@@H](CO)c1ccccc1)C1CCN(CCCc2c[nH]c3ccc(cc23)-n2cnnc2)CC1
BDBM50083127 C(CN1CCC(CC1)NCc1cccnc1)Cc1c[nH]c2ccc(cc12)-n1cnnc1
BDBM50083128 OC[C@@H](NC1CCN(CCCc2c[nH]c3ccc(cc23)-n2cnnc2)CC1)c1ccccc1
BDBM50083129 O=c1[nH]c2ccccc2n1C1CCN(CCCc2c[nH]c3ccc(cc23)-n2cnnc2)CC1
BDBM50083130 C(CN1CCC(CC1)NCc1ccncc1)Cc1c[nH]c2ccc(cc12)-n1cnnc1
BDBM50083131 CN(CC1CCN(CCCc2c[nH]c3ccc(cc23)-n2cnnc2)CC1)C(=O)Nc1ccccc1
BDBM50083132 O=S(=O)(NCC1CCN(CCCc2c[nH]c3ccc(cc23)-n2cnnc2)CC1)c1ccccc1
BDBM50083133 CC(=O)Nc1ccc(CNC2CCN(CCCc3c[nH]c4ccc(cc34)-n3cnnc3)CC2)cc1
BDBM50083134 C[C@@H](NC1CCN(CCCc2c[nH]c3ccc(cc23)-n2cnnc2)CC1)C(=O)Nc1ccccc1
BDBM50083135 C[C@H](NCC1CCN(CCCc2c[nH]c3ccc(cc23)-n2cnnc2)CC1)c1ccccc1
BDBM50083136 C(CN1CCC(CC1)NCc1ccoc1)Cc1c[nH]c2ccc(cc12)-n1cnnc1
BDBM50083137 OC[C@H](NC1CCN(CCCc2c[nH]c3ccc(cc23)-n2ccnc2)CC1)c1ccccc1
BDBM50083138 OC[C@H](NCC1CCN(CCCc2c[nH]c3ccc(cc23)-n2cnnc2)CC1)c1ccccc1
BDBM50083139 CN([C@H](CO)c1ccccc1)C1CCN(CCCc2c[nH]c3ccc(cc23)-n2cnnc2)CC1
BDBM50083140 CN(CC1CCN(CCCc2c[nH]c3ccc(cc23)-n2cnnc2)CC1)Cc1ccc(cc1)S(C)(=O)=O
BDBM50083141 C(CN1CCC(CNC2CCc3ccccc23)CC1)Cc1c[nH]c2ccc(cc12)-n1cnnc1
BDBM50083142 CC(=O)Nc1ccc(CNCC2CCN(CCCc3c[nH]c4ccc(cc34)-n3cnnc3)CC2)cc1
BDBM50083143 CN(Cc1ccc(cc1)S(C)(=O)=O)C1CCN(CCCc2c[nH]c3ccc(cc23)-n2cnnc2)CC1
BDBM50083144 CC(NC1CCN(CCCc2c[nH]c3ccc(cc23)-n2cnnc2)CC1)c1ccc(F)cc1
BDBM50083145 C(CN1CCC(CC1)NC1CCc2ccccc12)Cc1c[nH]c2ccc(cc12)-n1cnnc1
BDBM50083146 CN(Cc1ccoc1)C1CCN(CCCc2c[nH]c3ccc(cc23)-n2cnnc2)CC1
BDBM50083147 CN(CC1CCN(CCCc2c[nH]c3ccc(cc23)-n2cnnc2)CC1)S(=O)(=O)c1ccccc1
BDBM50083148 CN(CC=C)C1CCN(CCCc2c[nH]c3ccc(cc23)-n2cnnc2)CC1
BDBM50083149 C[C@H](NC1CCN(CCCc2c[nH]c3ccc(cc23)-n2cnnc2)CC1)c1ccccc1
BDBM50083150 CN(CC1CCN(CCCc2c[nH]c3ccc(cc23)-n2cnnc2)CC1)[C@@H](CO)c1ccccc1
BDBM50083151 COC[C@H](NC1CCN(CCCc2c[nH]c3ccc(Cn4cncn4)cc23)CC1)c1ccc(F)cc1
BDBM50083153 C(CN1CCC(CC1)N1CCCCC1c1ccccc1)Cc1c[nH]c2ccc(cc12)-n1cnnc1
BDBM50086096 CN1CCC2(COc3ccc(NC(=O)c4ccc(cc4)-c4ccc(cc4C)-c4noc(C)n4)cc23)CC1
BDBM50090515 CN1CCC[C@@H]1Cc1c[nH]c2ccc(C)cc12
BDBM50090516 CN1CCC[C@@H]1Cc1c[nH]c2ccc(cc12)C(C)(C)C
BDBM50090517 CC(C)c1ccc2[nH]cc(C[C@H]3CCCN3C)c2c1
BDBM50090518 CC(C)c1ccc2[nH]cc(CCN3CCCC3)c2c1
BDBM50090647 C[C@@H]1OC(=O)N([C@H]1c1ccc(F)c(F)c1)C(=O)NCCCN1CCC(CC1)c1ccc(F)cc1 |r|
BDBM50090519 CC(C)c1ccc2[nH]cc(CCN(C)C)c2c1
BDBM50090520 CCc1ccc2[nH]cc(CCN3CCCC3)c2c1
BDBM50090521 CC(C)(C)c1ccc2[nH]cc(CCN3CCCC3)c2c1
BDBM50090522 CCc1ccc2[nH]cc(C[C@H]3CCCN3C)c2c1
BDBM50088863 NCCc1c[nH]c2ccc(cc12)-c1cccs1
BDBM50088864 COC[C@@H]1CCCN1CCc1c[nH]c2ccc(cc12)-c1cccs1
BDBM50088865 OC[C@@H]1CCCN1CCc1c[nH]c2ccc(cc12)-c1cccs1
BDBM50088866 CN(C)CCc1c[nH]c2ccc(cc12)-c1ccc(C)s1
BDBM50088867 CN(C)CCc1c[nH]c2ccc(cc12)-c1cccs1
BDBM50088868 C(Cc1c[nH]c2ccc(cc12)-c1cccs1)N1CC=CC1 |c:21|
BDBM50088869 CC1CCC(C)N1CCc1c[nH]c2ccc(cc12)-c1cccs1
BDBM50088870 CN(C)CCc1c[nH]c2ccc(cc12)-c1ccsc1
BDBM50088861 C(Cc1c[nH]c2ccc(cc12)-c1cccs1)N1CCCC1
BDBM50088862 Clc1ccc(s1)-c1ccc2[nH]cc(CCN3CCCC3)c2c1
BDBM50088860 CN(C)CCc1c[nH]c2ccc(cc12)-c1ccc(Cl)s1
BDBM50098550 C[C@H](CCN1CCC(C)CC1)N(C)S(=O)(=O)c1cccc(C)c1
BDBM50098551 CC1CCN(CC[C@H]2CCCN2S(=O)(=O)c2cccc(O)c2)CC1 |r|
BDBM50095890 OCCOCCN1CCN(CC1)C1=Nc2ccccc2Sc2ccccc12 |t:13|
BDBM50099887 Fc1ccccc1N1CCN(Cc2c[nH]c3ncccc23)CC1
BDBM50099888 CCc1ccc(cc1)N1CCN(Cc2c[nH]c3ncccc23)CC1
BDBM50099889 C=Cc1ccc(cc1)N1CCN(Cc2c[nH]c3ncccc23)CC1
BDBM50099890 COc1ccccc1N1CCN(Cc2c[nH]c3ncccc23)CC1
BDBM50099891 FC(F)(F)c1ccc(cc1)N1CCN(Cc2c[nH]c3ncccc23)CC1
BDBM50099892 CSc1ccc(cc1)N1CCN(Cc2c[nH]c3ncccc23)CC1
BDBM50099893 Fc1ccc(cc1)N1CCN(Cc2c[nH]c3ncccc23)CC1
BDBM50099894 CCCc1ccc(cc1)N1CCN(Cc2c[nH]c3ncccc23)CC1
BDBM50099895 C(N1CCN(CC1)c1ccc(cc1)-c1ccccc1)c1c[nH]c2ncccc12
BDBM50106482 CN(C)CCc1c(C)[nH]c2cccc(NC(=O)c3ccc(F)cc3)c12
BDBM50106246 CN(C)CCc1cccc2n(c(cc12)C(=O)c1ccccc1)S(=O)(=O)c1ccccc1
BDBM50106248 CN(C)[C@H]1Cc2cn(c3cccc([C@@H]1O)c23)S(=O)(=O)c1ccc(C)cc1
BDBM50106249 CN(C)CCc1cccc2n(ccc12)S(=O)(=O)c1ccccc1
BDBM50106250 CN(C)CCc1cn(c2ccccc12)S(=O)(=O)c1ccccc1
BDBM50106251 NCCc1cccc2n(ccc12)S(=O)(=O)c1ccccc1
BDBM50106252 CN(C)CCc1cn(C(=O)c2ccccc2)c2ccc(O)cc12
BDBM50106247 CCOC(=O)c1[nH]c2ccccc2c1CCN(C)C
BDBM50105061 Clc1cc2OCOc2cc1COC(=O)N1CCC(CC1)n1c2ccccc2[nH]c1=O
BDBM50105105 Fc1ccc(cc1)C(CCCN1CCC(CC1)NC(=O)OCCc1ccc(cc1)C#N)c1ccc(F)cc1
BDBM50122798 Cn1ccnc1-c1ccc2n(cc(C3CCN(CCN4CCNC4=O)CC3)c2c1)-c1ccc(F)cc1
BDBM50122799 Cn1ccc(n1)-c1ccc2n(cc(C3CCN(CCN4CCNC4=O)CC3)c2c1)-c1ccc(F)cc1
BDBM50122800 Fc1ccc(cc1)-n1cc(C2CCN(CCN3CCNC3=O)CC2)c2cc(ccc12)-c1cccnc1
BDBM50122801 CCn1cc(nn1)-c1ccc2n(cc(C3CCN(CCN4CCNC4=O)CC3)c2c1)-c1ccc(F)cc1
BDBM50122802 Cn1nccc1-c1ccc2n(cc(C3CCN(CCN4CCNC4=O)CC3)c2c1)-c1ccc(F)cc1
BDBM50122803 C[C@H](CN1CCN(CC1)c1cc(F)c(F)cc1F)N1C(=O)CC2(CCCC2)CC1=O
BDBM50122804 Cn1cc(cn1)-c1ccc2n(cc(C3CCN(CCN4CCNC4=O)CC3)c2c1)-c1ccc(F)cc1
BDBM50122805 Cn1ncc(n1)-c1ccc2n(cc(C3CCN(CCN4CCNC4=O)CC3)c2c1)-c1ccc(F)cc1
BDBM50122806 Fc1ccc(cc1)-n1cc(C2CCN(CCC#N)CC2)c2cc(ccc12)-c1ncccn1
BDBM50122807 Cn1cc(nn1)-c1ccc2n(cc(C3CCN(CCN4CCNC4=O)CC3)c2c1)-c1ccc(F)cc1
BDBM50122808 Fc1ccc(cc1)-n1cc(C2CCN(CCN3CCOC3=O)CC2)c2cc(ccc12)-c1ncccn1
BDBM50122809 CN1CCC(CCN2CCC(CC2)c2cn(-c3ccc(F)cc3)c3ccc(cc23)-c2ncn(C)n2)C1=O
BDBM50122810 Cn1cnc(n1)-c1ccc2n(cc(C3CCN(CCC#N)CC3)c2c1)-c1ccc(F)cc1
BDBM50122811 Cn1cnc(n1)-c1ccc2n(cc(C3CCN(CCN4CCNC4=O)CC3)c2c1)-c1ccc(F)cc1
BDBM50122813 Cn1nnc(n1)-c1ccc2n(cc(C3CCN(CCN4CCOC4=O)CC3)c2c1)-c1ccc(F)cc1
BDBM50122814 Fc1ccc(cc1)-n1cc(C2CCN(CCN3CCNC3=O)CC2)c2cc(ccc12)-c1ncccn1
BDBM50122815 Cn1nnc(n1)-c1ccc2n(cc(C3CCN(CCN4CCNC4=O)CC3)c2c1)-c1ccc(F)cc1
BDBM50122816 Cn1nncc1-c1ccc2n(cc(C3CCN(CCN4CCNC4=O)CC3)c2c1)-c1ccc(F)cc1
BDBM50122817 Cn1cnc(n1)-c1ccc2n(cc(C3CCN(CCn4c(=O)[nH]c5ccccc5c4=O)CC3)c2c1)-c1ccc(F)cc1
BDBM50122818 Cn1cnnc1-c1ccc2n(cc(C3CCN(CCN4CCNC4=O)CC3)c2c1)-c1ccc(F)cc1
BDBM50122819 Fc1ccc(cc1)-n1cc(C2CCN(CCN3CCNC3=O)CC2)c2cc(ccc12)-c1cncnc1
BDBM50122820 CCn1ncc(n1)-c1ccc2n(cc(C3CCN(CCN4CCNC4=O)CC3)c2c1)-c1ccc(F)cc1
BDBM50122821 Cn1ncnc1-c1ccc2n(cc(C3CCN(CCN4CCNC4=O)CC3)c2c1)-c1ccc(F)cc1
BDBM50122822 Fc1ccc(cc1)-n1cc(C2CCN(CCN3CCNC3=O)CC2)c2cc(ccc12)-c1c[nH]nn1
BDBM50122824 Cn1cnc(n1)-c1ccc2n(cc(C3CCN(CCN4CCOC4=O)CC3)c2c1)-c1ccc(F)cc1
BDBM50122825 Cn1nnnc1-c1ccc2n(cc(C3CCN(CCN4CCNC4=O)CC3)c2c1)-c1ccc(F)cc1
BDBM50122872 COCCCN1CCC(CC1)NC(=O)c1cc(Cl)c(N)c2CCOc12
BDBM50130427 CN1CCC(CC1)c1c[nH]c2ccc(NC(C)=O)cc12
BDBM50130429 CCCCCCCC(=O)Nc1ccc2[nH]cc(C3CCN(C)CC3)c2n1
BDBM50130431 CN1CCC(CC1)c1c[nH]c2cnc(NC(=O)c3ccc(F)cc3)cc12
BDBM50130432 CN1CCC(CC1)c1c[nH]c2ccc(NC(=O)c3ccc(cc3)C#N)nc12
BDBM50130433 CN1CCC(CC1)c1c[nH]c2ccc(NC(=O)C3CCC3)nc12
BDBM50130435 CN1CCC(CC1)c1c[nH]c2ccc(NC(=O)c3cccc(F)c3)nc12
BDBM50130436 CN1CCC(CC1)c1c[nH]c2ccc(NC(=O)c3cccc(C)c3)nc12
BDBM50130437 CN1CCC(CC1)c1c[nH]c2ccc(NC(=O)c3ccncc3)nc12
BDBM50130438 CN1CCC(CC1)c1c[nH]c2ccc(NC(=O)Nc3ccc(F)cc3)nc12
BDBM50130439 CN1CCC(CC1)c1c[nH]c2ccc(NC(=O)c3ccoc3)nc12
BDBM50130440 CN1CCC(CC1)c1c[nH]c2ccc(NC(=O)C3CC3)nc12
BDBM50130441 CN1CCC(CC1)c1c[nH]c2cnc(NC(=O)c3ccc(F)cc3)nc12
BDBM50130442 CN1CCC(CC1)c1c[nH]c2ccc(NC(=O)c3ccccn3)nc12
BDBM50130443 CN1CCC(CC1)c1c[nH]c2ccc(NC(=O)c3ccc(F)cc3)nc12
BDBM50130462 CN1CCC(CC1)c1c[nH]c2ccc(N)nc12
BDBM50130466 CN1CCC(CC1)c1c[nH]c2ccc(OS(C)(=O)=O)nc12
BDBM50129952 Oc1ccc(cc1)-c1cc(=O)c2c(O)cc(O)c(-c3cc(ccc3O)-c3cc(O)c4c(cc(O)cc4=O)o3)c2o1 |(13.25,-26.01,;14.59,-25.24,;14.59,-23.7,;15.92,-22.93,;17.26,-23.7,;17.26,-25.24,;15.93,-26.01,;18.58,-22.93,;19.91,-23.69,;21.23,-22.92,;22.57,-23.69,;21.22,-21.4,;22.56,-20.64,;23.88,-21.41,;22.55,-19.1,;21.22,-18.33,;21.22,-16.79,;19.9,-19.11,;18.57,-18.34,;17.23,-19.1,;15.9,-18.33,;15.9,-16.79,;17.23,-16.02,;18.57,-16.79,;19.91,-16.02,;14.57,-19.09,;14.56,-20.65,;13.21,-21.42,;13.21,-22.96,;11.87,-20.64,;11.88,-19.08,;10.54,-18.32,;9.21,-19.09,;7.87,-18.32,;9.21,-20.64,;10.54,-21.41,;10.54,-22.95,;13.22,-18.3,;19.9,-20.64,;18.58,-21.4,)|
BDBM50130278 CC1CCN(CC[C@H]2CCCN2S(=O)(=O)c2cccc3ccccc23)CC1
BDBM50130279 CC1CCN(CC[C@H]2CCCN2S(=O)(=O)c2cccc(C)c2)CC1
BDBM50130467 CN1CCC(CC1)c1c[nH]c2ccc(NC(=O)c3cccs3)nc12
BDBM50130470 COc1ccc2[nH]cc(C3CCN(C)CC3)c2n1
BDBM50130471 CNC(=O)Nc1ccc2[nH]cc(C3CCN(C)CC3)c2n1
BDBM50130445 CN1CCC(CC1)c1c[nH]c2ccc(NC(=O)c3ccccc3)nc12
BDBM50130293 Clc1cccc(N2CCN(CCCCOc3ccc4CCC(=O)Nc4c3)CC2)c1Cl
BDBM50130446 CN1CCC(CC1)c1c[nH]c2ccc(NC(=O)C3CCCC3)nc12
BDBM50130447 CN1CCC(CC1)c1c[nH]c2ccc(NC(=O)c3ccsc3)nc12
BDBM50130448 CN1CCC(CC1)c1c[nH]c2ccc(NC(C)=O)nc12
BDBM50130419 CN1CCC(CC1)c1c[nH]c2cnc(NC(C)=O)nc12
BDBM50130420 CN1CCC(CC1)c1c[nH]c2ccc(NC(=O)c3ccco3)nc12
BDBM50130421 CN1CCC(CC1)c1c[nH]c2ccc(NC(=O)c3cccc(c3)C#N)nc12
BDBM50130426 CCC(=O)Nc1ccc2[nH]cc(C3CCN(C)CC3)c2n1
BDBM50130451 CN1CCC(CC1)c1c[nH]c2ccc(NC(=O)c3ccc(cc3)[N+]([O-])=O)nc12
BDBM50130453 CN1CCC(CC1)c1c[nH]c2ccc(NC(=O)c3cccc(c3)[N+]([O-])=O)nc12
BDBM50130454 COc1ccccc1C(=O)Nc1ccc2[nH]cc(C3CCN(C)CC3)c2n1
BDBM50130455 CN1CCC(CC1)c1c[nH]c2ccc(NS(C)(=O)=O)nc12
BDBM50130458 CN1CCC(CC1)c1c[nH]c2ccc(NC(=O)c3ccccc3C)nc12
BDBM50130461 CN1CCC(CC1)c1c[nH]c2ccc(NC(=O)c3ccc(F)cc3)cc12
BDBM50130268 COc1ccc(cc1N1CCNCC1)S(=O)(=O)Nc1cc(Br)cc(F)c1Br
BDBM50133451 CN1CCC[C@@H]1Cc1c[nH]c2ccc(cc12)C1=CCN(CC1)C(=S)Nc1ccc(Cl)cc1 |t:19|
BDBM50133452 COc1ccc(cc1)S(=O)(=O)N1CCC(=CC1)c1ccc2[nH]cc(C[C@H]3CCCN3C)c2c1 |c:15|
BDBM50133453 COc1ccc(NC(=S)N2CCC(=CC2)c2ccc3[nH]cc(C[C@H]4CCCN4C)c3c2)cc1 |c:12|
BDBM50133454 CN1CCC[C@@H]1Cc1c[nH]c2ccc(cc12)C1=CCN(CC1)C(=O)Nc1ccc(C)cc1 |t:19|
BDBM50133455 CN1CCC[C@@H]1Cc1c[nH]c2ccc(cc12)C1=CCN(CC1)S(=O)(=O)c1cccc2ccccc12 |t:19|
BDBM50133456 CN1CCC[C@@H]1Cc1c[nH]c2ccc(cc12)C1=CCN(CC1)C(=O)NC1CCCCC1 |t:19|
BDBM50133457 COc1ccc(NC(=O)N2CCC(=CC2)c2ccc3[nH]cc(C[C@H]4CCCN4C)c3c2)cc1 |c:12|
BDBM50133458 CN1CCC[C@@H]1Cc1c[nH]c2ccc(cc12)C1=CCN(CC1)C(=S)Nc1ccccc1 |t:19|
BDBM50133459 CN1CCC[C@@H]1Cc1c[nH]c2ccc(cc12)C1=CCN(CC1)C(=S)Nc1cccc2ccccc12 |t:19|
BDBM50133460 CN(C)CCc1c[nH]c2ccc(cc12)C1=CCN(C)CC1 |t:16|
BDBM50133461 CN1CCC[C@@H]1Cc1c[nH]c2ccc(cc12)C1=CCN(CC1)C(=S)NC12C[C@H]3C[C@H](C[C@H](C3)C1)C2 |t:19,TLB:32:31:34:27.26.28,32:27:34:31.33.30|
BDBM50133462 CN1CCC[C@@H]1Cc1c[nH]c2ccc(cc12)C1=CCN(CC1)C(=S)Nc1ccc(C)cc1 |t:19|
BDBM50133463 CN1CCC[C@@H]1Cc1c[nH]c2ccc(cc12)C1=CCN(CC1)C(=O)NC12C[C@H]3C[C@H](C[C@H](C3)C1)C2 |t:19,TLB:28:29:33:27.26.32,THB:28:27:33:29.34.30|
BDBM50133464 CN1CCC[C@@H]1Cc1c[nH]c2ccc(cc12)C1=CCN(CC1)S(=O)(=O)c1ccc(C)cc1 |t:19|
BDBM50133465 CN1CCC[C@@H]1Cc1c[nH]c2ccc(cc12)C1=CCN(CC1)C(=O)Nc1ccccc1 |t:19|
BDBM50133466 CN1CCC[C@@H]1Cc1c[nH]c2ccc(cc12)C1=CCN(CC1)C(=O)Nc1ccc(Cl)cc1 |t:19|
BDBM50133467 CN1CCC[C@@H]1Cc1c[nH]c2ccc(cc12)C1=CCN(CC1)C(=S)NC1CCCCC1 |t:19|
BDBM50133468 CN1CCC[C@@H]1Cc1c[nH]c2ccc(cc12)C1=CCN(CC1)C(=O)Nc1cccc2ccccc12 |t:19|
BDBM50133229 CC(N)Cc1c[nH]c2ccc3OCCCc3c12
BDBM50133232 C[C@H](N)Cc1c[nH]c2ccc3OCCCc3c12
BDBM50132097 COc1ccc2c3CCNCc3[nH]c2c1
BDBM50132104 COc1ccc2[nH]c3c(CCN=C3C)c2c1 |c:11|
BDBM50136493 CC1=NCCc2c1[nH]c1ccccc21 |t:1|
BDBM50139506 COc1ccc(cc1)S(=O)(=O)N1CCC(=CC1)c1ccc2[nH]cc(CCN3CCCC3)c2c1 |c:15|
BDBM50139507 O=S(=O)(N1CCC(=CC1)c1ccc2[nH]cc(CCN3CCCC3)c2c1)c1cccc2ccccc12 |c:6|
BDBM50139508 O=S(=O)(N1CCC(=CC1)c1ccc2[nH]cc(CCN3CCCC3)c2c1)c1ccccc1 |c:6|
BDBM50139509 C(Cc1c[nH]c2ccc(cc12)C1=CCNCC1)N1CCCC1 |t:13|
BDBM50139510 Clc1ccc(cc1)S(=O)(=O)N1CCC(=CC1)c1ccc2[nH]cc(CCN3CCCC3)c2c1 |c:14|
BDBM50139511 S=C(NN1CCC(=CC1)c1ccc2[nH]cc(CCN3CCCC3)c2c1)C12CC3CC(CC(C3)C1)C2 |c:6,TLB:28:29:33:26.27.32,THB:28:27:33:34.29.30,30:31:26:34.29.28,30:29:26:33.31.32|
BDBM50139512 Cc1ccc(cc1)S(=O)(=O)N1CCC(=CC1)c1ccc2[nH]cc(CCN3CCCC3)c2c1 |c:14|
BDBM50139513 Cc1ccc(cc1)C(=S)NN1CCC(=CC1)c1ccc2[nH]cc(CCN3CCCC3)c2c1 |c:14|
BDBM50139514 O=C(NN1CCC(=CC1)c1ccc2[nH]cc(CCN3CCCC3)c2c1)c1cccc2ccccc12 |c:6|
BDBM50139515 O=C(NN1CCC(=CC1)c1ccc2[nH]cc(CCN3CCCC3)c2c1)C12CC3CC(CC(C3)C1)C2 |c:6,TLB:28:29:33:26.27.32,THB:28:27:33:34.29.30,30:31:26:34.29.28,30:29:26:33.31.32|
BDBM50139516 S=C(NN1CCC(=CC1)c1ccc2[nH]cc(CCN3CCCC3)c2c1)c1cccc2ccccc12 |c:6|
BDBM50139517 S=C(NN1CCC(=CC1)c1ccc2[nH]cc(CCN3CCCC3)c2c1)c1ccccc1 |c:6|
BDBM50139518 S=C(NN1CCC(=CC1)c1ccc2[nH]cc(CCN3CCCC3)c2c1)C1CCCCC1 |c:6|
BDBM50139519 O=C(NN1CCC(=CC1)c1ccc2[nH]cc(CCN3CCCC3)c2c1)c1ccccc1 |c:6|
BDBM50139520 Clc1ccc(cc1)C(=S)NN1CCC(=CC1)c1ccc2[nH]cc(CCN3CCCC3)c2c1 |c:14|
BDBM50139521 O=C(NN1CCC(=CC1)c1ccc2[nH]cc(CCN3CCCC3)c2c1)C1CCCCC1 |c:6|
BDBM50139502 COc1ccc(cc1)C(=O)NN1CCC(=CC1)c1ccc2[nH]cc(CCN3CCCC3)c2c1 |c:15|
BDBM50139503 Clc1ccc(cc1)C(=O)NN1CCC(=CC1)c1ccc2[nH]cc(CCN3CCCC3)c2c1 |c:14|
BDBM50139504 Cc1ccc(cc1)C(=O)NN1CCC(=CC1)c1ccc2[nH]cc(CCN3CCCC3)c2c1 |c:14|
BDBM50139505 COc1ccc(cc1)C(=S)NN1CCC(=CC1)c1ccc2[nH]cc(CCN3CCCC3)c2c1 |c:15|
BDBM50145332 COc1ccc2[nH]cc(C3=CCN(CCC4OCCc5cc(ccc45)C(N)=O)CC3)c2c1 |t:9|
BDBM50145333 NC(=O)c1ccc2C(CCN3CCC(=CC3)c3cccc4ccccc34)OCCc2c1 |c:13|
BDBM50145334 NC(=O)c1ccc2C(CCN3CCN(CC3)c3c[nH]c4cc(F)ccc34)OCCc2c1
BDBM50145336 NC(=O)c1ccc2C(CCN3CCC(=CC3)c3csc4cc(F)ccc34)OCCc2c1 |c:13|
BDBM50145337 NC(=O)c1ccc2C(CCN3CCC(CC3)c3c[nH]c4cc(F)ccc34)OCCc2c1
BDBM50145338 C[C@H]1CC(CCN1CCC1OCCc2cc(ccc12)C(N)=O)c1c[nH]c2cc(F)ccc12
BDBM50145339 NC(=O)c1ccc2C(CCN3CCC(=CC3)c3noc4cc(F)ccc34)OCCc2c1 |c:13|
BDBM50145341 NC(=O)c1ccc2C(CCN3CCC(=CC3)c3c[nH]c4ccc(F)cc34)OCCc2c1 |c:13|
BDBM50145342 NC(=O)c1ccc2C(CCN3CCC(=CC3)c3c[nH]c4cc(Cl)ccc34)OCCc2c1 |c:13|
BDBM50145343 NC(=O)c1ccc2C(CCN3CCC(=CC3)c3coc4cc(F)ccc34)OCCc2c1 |c:13|
BDBM50145344 Cn1cc(C2=CCN(CCC3OCCc4cc(ccc34)C(N)=O)CC2)c2ccc(F)cc12 |t:4|
BDBM50145345 NC(=O)c1ccc2C(CCN3CCC(CC3)c3cccc4ccccc34)OCCc2c1
BDBM50145346 NC(=O)c1ccc2C(CCN3CCC(=CC3)c3c[nH]c4cc(ccc34)C(F)(F)F)OCCc2c1 |c:13|
BDBM50145347 NC(=O)c1ccc2C(CCN3CCC(=CC3)c3c[nH]c4cc(F)ccc34)OCCc2c1 |c:13|
BDBM50145348 NC(=O)c1ccc2C(CCN3CCC(CC3)c3nsc4cc(F)ccc34)OCCc2c1
BDBM50145349 NC(=O)c1ccc2C(CCN3CCC(=CC3)c3c[nH]c4c(F)cccc34)OCCc2c1 |c:13|
BDBM50145350 Cn1nc(C2=CCN(CCC3OCCc4cc(ccc34)C(N)=O)CC2)c2ccc(F)cc12 |t:4|
BDBM50145351 NC(=O)c1ccc2C(CCN3CCC(=CC3)c3ccc4cc(F)ccc4c3)OCCc2c1 |c:13|
BDBM50145352 NC(=O)c1ccc2C(CCN3CCC(C3)c3c[nH]c4cc(F)ccc34)OCCc2c1
BDBM50145353 NC(=O)c1ccc2C(CCN3CCC(=CC3)c3cccc4ccc(F)cc34)OCCc2c1 |c:13|
BDBM50145354 NC(=O)c1ccc2C(CCN3CCC(=CC3)c3[nH]nc4cc(F)ccc34)OCCc2c1 |c:13|
BDBM50145355 NC(=O)c1ccc2C(CCN3CCC(=CC3)c3c[nH]c4c(Cl)c(Cl)ccc34)OCCc2c1 |c:13|
BDBM50145356 NC(=O)c1ccc2C(CCN3CCC(=CC3)c3c[nH]c4c(F)c(F)ccc34)OCCc2c1 |c:13|
BDBM50145357 NC(=O)c1ccc2C(CCN3CCC(=CC3)c3c[nH]c4c(cccc34)C#N)OCCc2c1 |c:13|
BDBM50132341 COc1cc2CCN(C)C3Cc4cc5OCOc5cc4-c(c1OCc1ccc(Br)cc1)c23
BDBM50151702 Cc1cc(cc(C)c1CC1=NCCCN1)C(C)(C)C |t:10|
BDBM50151703 Cc1cc(cc(C)c1CC1=NCCN1Cc1ccccc1)C(C)(C)C |t:10|
BDBM50151705 [#6]-c1cc(cc(-[#6])c1\[#7]=[#6]-1/[#7]-[#6]-[#6]-[#7]-1)C([#6])([#6])[#6]
BDBM50151706 [#6]-c1cccc(-[#6])c1\[#7]=[#6]-1\[#7]-[#6]-[#6]-[#7]-1
BDBM50151707 Cc1cc(cc(C)c1\[NH+]=C1\NCC[N-]1)[N+]([O-])=O
BDBM50151708 [#6]-c1cc(Br)cc(-[#6])c1\[#7]=[#6]-1/[#7]-[#6]-[#6]-[#7]-1
BDBM50151709 [#6]-1-[#6]-[#7]\[#6](-[#7]-1)=[#7]/c1ccccc1
BDBM50156404 CN1CCC(CC1)N1CCc2ccc(NC(=O)c3ccc(F)cc3)cc12
BDBM50156407 CN1CCC(CC1)n1ccc2ccc(NC(=O)c3ccc(F)cc3)cc12
BDBM50156410 CN1CCC(CC1)c1n[nH]c2ccc(NC(=O)c3ccc(F)cc3)cc12
BDBM50156411 CN1CCC(CC1)n1ncc2ccc(NC(=O)c3ccc(F)cc3)cc12
BDBM50160160 COc1cc2CCN(C)[C@H]3Cc4cc5OCOc5cc4-c(c1OC)c23
BDBM50158610 C[C@@H]1CCCN1CCc1cc2cc(ccc2o1)C(=O)c1ccc(F)cc1
BDBM50159165 COC(=O)[C@@H]1C[C@H](OC(C)=O)C(=O)[C@H]2[C@@]1(C)CC[C@H]1C(=O)O[C@@H](C[C@]21C)c1ccoc1 |r|
BDBM50159175 Clc1ccccc1S(=O)(=O)Nc1ccc2[nH]cc(CC3CCCN3)c2c1
BDBM50159180 CN1CCCC1Cc1c[nH]c2ccc(NS(=O)(=O)c3ccccc3Cl)cc12
BDBM50159187 CN1CCCC1Cc1c[nH]c2ccc(NS(=O)(=O)c3cccc(Cl)c3)cc12
BDBM50164447 NC(CCS(O)(=O)=O)C(O)=O
BDBM50167898 O=C(NC1CC[C@H](CCN2CCc3cc(ccc3C2)C#N)CC1)c1ccnc2ccccc12 |wD:6.6,(-3.87,-1.76,;-3.86,-3.3,;-2.52,-4.08,;-1.18,-3.3,;-1.19,-1.76,;.15,-.99,;1.48,-1.76,;2.83,-.99,;4.16,-1.76,;5.49,-.99,;5.49,.54,;6.84,1.31,;8.17,.53,;9.5,1.3,;10.83,.53,;10.81,-1.01,;9.48,-1.78,;8.16,-1.01,;6.84,-1.78,;12.17,1.29,;13.5,2.07,;1.48,-3.3,;.15,-4.08,;-5.19,-4.09,;-5.19,-5.64,;-6.54,-6.41,;-7.87,-5.64,;-7.87,-4.09,;-9.19,-3.33,;-9.2,-1.81,;-7.87,-1.03,;-6.54,-1.78,;-6.54,-3.33,)|
BDBM50171290 CCc1c(nn(c1-c1ccc(Br)cc1)-c1ccc(Cl)cc1Cl)C(=O)NN1CCCCC1
BDBM50171235 Cc1[nH]c2ccc(Cl)cc2c1C1=CCNCC1 |t:13|
BDBM50173091 COc1ccc(NC(=O)N2CCN(CC2)c2ccc(Cl)cc2)cc1N1CCN(C)CC1
BDBM50173092 COc1ccc(NC(=O)N2CCN(CC2)c2ccccc2F)cc1N1CCN(C)CC1
BDBM50173093 COc1ccccc1N1CCC(CC1)C(=O)Nc1ccc(OC)c(c1)N1CCN(C)CC1
BDBM50173094 COc1ccc(NC(=O)N2CCN(CC2)c2ccc(SC)cc2)cc1N1CCN(C)CC1
BDBM50173095 COc1ccc(NC(=O)N2CCN(CC2)c2ccccc2Cl)cc1N1CCN(C)CC1
BDBM50173096 COc1ccc(NC(=O)N2CCN(CC2)c2ccc(cc2)-c2ccccc2)cc1N1CCN(C)CC1
BDBM50173097 COc1ccc(NC(=O)N2CCN(CC2)c2ccc(cc2)C(F)(F)F)cc1N1CCN(C)CC1
BDBM50173098 COc1ccccc1N1CCN(CC1)C(=O)Nc1ccc(OC)c(c1)N1CCN(C)CC1
BDBM50173090 COc1ccc(NC(=O)N2CCN(CC2)c2ccc(F)cc2)cc1N1CCN(C)CC1
BDBM50172414 CN(C)CCOc1cc(C)c2cc(NC(=O)COc3ccc(Cl)cc3Cl)ccc2n1
BDBM50172421 CN(C)CCN(C)c1cc(C)c2cc(NC(=O)\C=C\c3ccc(OC(F)(F)F)cc3)ccc2n1
BDBM50175501 C[C@@H]1CN(CCN1CCC1OCCc2c(Cl)c(sc12)C(N)=O)c1cccc2cc(F)ccc12
BDBM50175460 CC(C)Oc1ccccc1N1CCN(CCn2cnc3sc4CN(C)CCc4c3c2=O)CC1
BDBM50175461 CN1CCc2c(C1)sc1ncn(CCN3CCN(CC3)c3cncc4ccccc34)c(=O)c21
BDBM50175462 COc1c(Cl)cc(Cl)cc1N1CCN(CCn2cnc3sc4CN(C)CCc4c3c2=O)CC1
BDBM50175463 COc1c(Cl)cccc1N1CCN(CCn2cnc3sc4CN(C)CCc4c3c2=O)CC1
BDBM50175464 CN1CCc2c(C1)sc1ncn(CCN3CCN(CC3)c3ccccc3OCc3ccccc3)c(=O)c21
BDBM50175465 CN1CCc2c(C1)sc1ncn(CCN3CCN(CC3)c3ccnc4ccccc34)c(=O)c21
BDBM50175466 COc1ccc(cc1N1CCN(CCn2cnc3sc4CN(C)CCc4c3c2=O)CC1)-c1ccccc1
BDBM50175467 CN1CCc2c(C1)sc1ncn(CCN3CCN(CC3)c3nccc4ccccc34)c(=O)c21
BDBM50175468 COc1ccc2ccccc2c1N1CCN(CCn2cnc3sc4CN(C)CCc4c3c2=O)CC1
BDBM50175469 COc1ccc(Cl)cc1N1CCN(CCn2cnc3sc4CN(C)CCc4c3c2=O)CC1
BDBM50175470 CN1CCc2c(C1)sc1ncn(CCN3CCN(CC3)c3ccccc3Oc3ccccc3)c(=O)c21
BDBM50175471 CN1CCc2c(C1)sc1ncn(CCN3CCN(CC3)c3ccccc3-c3ccccc3)c(=O)c21
BDBM50175472 CN1CCc2c(C1)sc1ncn(CCN3CCN(CC3)c3ccccc3OCC(C)(C)C)c(=O)c21
BDBM50175473 CN1CCc2c(C1)sc1ncn(CCN3CCN(CC3)c3cccc4cnccc34)c(=O)c21
BDBM50175474 CN1CCc2c(C1)sc1ncn(CCN3CCN(CC3)c3ccccc3Cl)c(=O)c21
BDBM50175475 COc1ccc(cc1N1CCN(CCn2cnc3sc4CN(C)CCc4c3c2=O)CC1)C(F)(F)F
BDBM50175476 COc1ccc(C)cc1N1CCN(CCn2cnc3sc4CN(C)CCc4c3c2=O)CC1
BDBM50175477 CN1CCc2c(C1)sc1ncn(CCN3CCN(CC3)c3cccc4CCOc34)c(=O)c21
BDBM50175478 COc1ccc(OC)c(c1)N1CCN(CCn2cnc3sc4CN(C)CCc4c3c2=O)CC1
BDBM50175479 CN1CCc2c(C1)sc1ncn(CCN3CCN(CC3)c3cccc4cccnc34)c(=O)c21
BDBM50175480 CN1CCc2c(C1)sc1ncn(CCN3CCN(CC3)c3cccc4ncccc34)c(=O)c21
BDBM50175481 COc1cc(Cl)ccc1N1CCN(CCn2cnc3sc4CN(C)CCc4c3c2=O)CC1
BDBM50175482 CN1CCc2c(C1)sc1ncn(CCN3CCN(CC3)c3ccc4ccccc4n3)c(=O)c21
BDBM50175483 COc1cc(Cl)c(Cl)cc1N1CCN(CCn2cnc3sc4CN(C)CCc4c3c2=O)CC1
BDBM50175484 CN1CCc2c(C1)sc1ncn(CCN3CCN(CC3)c3cccc4ccncc34)c(=O)c21
BDBM50175485 CN1CCc2c(C1)sc1ncn(CCN3CCN(CC3)c3cccc4ccsc34)c(=O)c21
BDBM50175486 COc1ccccc1N1CCN(CCn2cnc3sc4CN(C)CCc4c3c2=O)CC1
BDBM50175487 CN1CCc2c(C1)sc1ncn(CCN3CCN(CC3)c3ccccc3C#N)c(=O)c21
BDBM50175488 CN1CCc2c(C1)sc1ncn(CCN3CCN(CC3)c3ncnc4ccccc34)c(=O)c21
BDBM50175489 CN1CCc2c(C1)sc1ncn(CCN3CCN(CC3)c3cccc4ccccc34)c(=O)c21
BDBM50175490 CN1CCc2c(C1)sc1ncn(CCN3CCN(CC3)c3ccccc3C)c(=O)c21
BDBM50174702 C[C@@H]1CN(Cc2ccc(F)cc2)CCN1C(=O)\C=C\c1ccc(Cl)cc1NC(C)=O
BDBM50179073 C[C@@H]1CNC[C@H]2Cc3ccc(COCC4CC4)nc3N12
BDBM50180251 C[C@H](N)Cn1ncc2ccc(O)cc12
BDBM50182020 COc1cccc(c1)N1CCN(CCCCn2ncc(=O)n(C)c2=O)CC1
BDBM50182548 CCCC(N1CCCC1)C(=O)c1cccc(C)c1
BDBM50182549 CCCC(N1CCCC1)C(=O)c1ccc(O)cc1
BDBM50182550 CCC(CC(=O)c1ccc(C)cc1)N1CCCC1
BDBM50182551 CCCC(N1CCCC1)C(=O)c1ccccc1C
BDBM50182553 CCCC(N1CCCC1)C(=O)c1ccc(cc1)C(F)(F)F
BDBM50182556 CCC(CC(=O)c1ccc(Cl)c(Cl)c1)N1CCCC1
BDBM50182560 CCC[C@H](N1CCCC1)C(=O)c1ccc(C)cc1
BDBM50182563 CCCC(N1CCCC1)C(=O)c1ccc(cc1)[N+]([O-])=O
BDBM50182569 CCCC(N1CCCC1)C(=O)c1ccc(OC)cc1
BDBM50182571 CCCC(N1CCCC1)C(=O)c1ccc(cc1)-c1cccs1
BDBM50182578 CCCC(N1CCCC1)C(=O)c1ccc(Br)cc1
BDBM50182579 CCCC(N1CCCC1)C(=O)c1ccc(NC(C)=O)cc1
BDBM50182546 CCCC(N1CCCC1)C(=O)c1ccc2ccccc2c1
BDBM50199557 COc1cc(N2CC[C@@H](C2)N(C)C)c2nc(cc(O)c2c1)C(=O)Nc1ccc(cc1)N1CCOCC1
BDBM50199558 CN1CCN(CC1)c1cc(F)cc2c(O)cc(nc12)C(=O)Nc1ccc(cc1)N1CCOCC1
BDBM50199559 COc1cc(N2CC[C@H](C2)N(C)C)c2nc(cc(O)c2c1)C(=O)Nc1ccc(cc1)N1CCOCC1
BDBM50199560 COc1cc(N(C)C2CCN(C)C2)c2nc(cc(O)c2c1)C(=O)Nc1ccc(cc1)N1CCOCC1
BDBM50199561 COc1cc(N(C)CCCN(C)C)c2nc(cc(O)c2c1)C(=O)Nc1ccc(cc1)N1CCOCC1
BDBM50199562 CCN(C1CCN(CC)C1)c1cc(OC)cc2c(O)cc(nc12)C(=O)Nc1ccc(cc1)N1CCOCC1
BDBM50199563 COc1cc(N(C)CCN(C)C)c2nc(cc(O)c2c1)C(=O)Nc1ccc(cc1)N1CCOCC1
BDBM50199564 COc1cc(N2CCN(C)CC2)c2nc(cc(N(C)C)c2c1)C(=O)Nc1ccc(cc1)N1CCOCC1
BDBM50199565 COc1cc(nc2c(cc(F)cc12)N1CCN(C)CC1)C(=O)Nc1ccc(cc1)N1CCOCC1
BDBM50199566 COc1cc(N2CCN(C)CC2)c2nc(cc(O)c2c1)C(=O)Nc1ccc(cc1)N1CCOCC1
BDBM50199567 COc1cc(N2CCCN(C)CC2)c2nc(cc(O)c2c1)C(=O)Nc1ccc(cc1)N1CCOCC1
BDBM50199568 CNc1cc(nc2c(cc(OC)cc12)N1CCN(C)CC1)C(=O)Nc1ccc(cc1)N1CCOCC1
BDBM50203566 OCC1CCCN(CCCC2CCCc3ccc(OCc4noc(n4)-c4ccc(Cl)cc4)cc23)C1 |w:10.9,2.1|
BDBM50203567 CC(C)N1CCN(CC1)C1CCc2ccc(OCc3noc(n3)-c3ccc(Cl)cc3)cc12 |w:9.9|
BDBM50203571 CN1CCN(CC1)c1cccc2ccc(OCc3noc(n3)-c3ccc(Cl)cc3)cc12
BDBM50203572 OCC1(CCCC1)N1CCN(CC1)C1CCc2ccc(OCc3noc(n3)-c3ccc(Cl)cc3)cc12 |w:13.14|
BDBM50203574 OCC1(CCCC1)NCCCC1CCc2ccc(OCc3noc(n3)-c3ccc(Cl)cc3)cc12 |w:11.11|
BDBM50203576 CC1CC(CC1C)N1CCN(CC1)C1CCc2ccc(OCc3noc(n3)-c3ccc(Cl)cc3)cc12 |w:13.14,3.7,1.0,5.6|
BDBM50210633 C[C@@H]1CN(CCN1CC[C@@H]1OCCc2cc(ccc12)C(N)=O)c1cccc2cc(F)ccc12
BDBM50210634 C[C@H]1CN(CCN1CC[C@H]1OCC2=CC(=CCC12)C(N)=O)c1cccc2cc(F)ccc12 |w:17.17,c:15,t:13|
BDBM50210635 NC(=O)c1ccc2[C@H](CCN3CCN(CC3)c3cccc4cc(ccc34)C#N)OCCc2c1
BDBM50210636 NC(=O)c1ccc2[C@H](CCN3CCN(CC3)c3ccc4cc(F)ccc4c3)OCCc2c1
BDBM50210637 C[C@H]1CN(CCN1CC[C@@H]1OCC2=CC(=CCC12)C(N)=O)c1cccc2cc(F)ccc12 |w:17.17,c:15,t:13|
BDBM50210638 C[C@@H]1CN(CCN1CCC1OCCc2cc(ccc12)C(N)=O)c1cccc2cc(F)ccc12 |w:9.9|
BDBM50210639 C[C@@H]1CN(CCN1CC[C@H]1OCCc2cc(ccc12)C(N)=O)c1cccc2cc(F)ccc12
BDBM50210640 C[C@H]1CN(CCN1CC[C@H]1OCC2=CC(=CCC12)C(N)=O)c1cccc2cc(ccc12)C#N |w:17.17,c:15,t:13|
BDBM50210641 C[C@H]1CN(CCN1CC[C@@H]1OCCc2cc(ccc12)C(N)=O)c1ccc2cc(F)ccc2c1
BDBM50210642 C[C@H]1CN(CCN1CC[C@@H]1OCCc2cc(ccc12)C(N)=O)c1cccc2cc(ccc12)C#N
BDBM50213737 Oc1cc(cc2c1N=C(Nc1ccccc1Oc1ccccc1)NS2(=O)=O)[N+]([O-])=O |t:8|
BDBM50212239 COc1cc(NC(=O)c2ccc(o2)-c2ccc(Cl)cc2)cc(OC)c1
BDBM50215552 FCc1nc(cs1)C#Cc1cc(F)cc(c1)C#N
BDBM50220147 N[C@@H](CCS(O)(=O)=O)C(O)=O |r|
BDBM50232152 COc1c(OCCF)cccc1C(O)C1CCN(CCc2ccc(F)cc2)CC1
BDBM50240797 CCCN(CCC)C1CCc2cc(CS(=O)(=O)c3ccc(OC)cc3)ccc2C1
BDBM50252513 Cc1nc2C(O)CCCn2c(=O)c1CCN1CCC(CC1)c1noc2cc(F)ccc12
BDBM50246936 CC(C)NC[C@H](O)COc1cccc2ccccc12 |r|
BDBM50242927 CN1CCN(C[C@H](c2cccc(OC(F)(F)F)c2)C2(O)CCCCC2)CC1 |r|
BDBM50243699 FC(F)(F)c1nc2cccc(OCCN3CCN(CC3)c3cccc4[nH]c(nc34)C(F)(F)F)c2[nH]1
BDBM50249134 CC(C)c1cc(nc(N)n1)-c1ccc(F)c2ccccc12
BDBM50267507 COc1c(OCCF)cccc1[C@H](O)C1CCN(CCc2ccc(F)cc2)CC1 |r|
BDBM50267508 COc1c(OCCF)cccc1C(=O)C1CCN(CCc2ccc(F)cc2)CC1
BDBM50267509 COc1c(OCCF)cccc1C(O)C1CCN(CCc2ccc(cc2)[N+]([O-])=O)CC1
BDBM50267510 COc1c(OCCF)cccc1C(O)C1CCN(CCc2ccc(C)cc2)CC1
BDBM50267554 COc1c(OCCF)cccc1C(=O)C1CCN(CCc2ccc(C)cc2)CC1
BDBM50267555 COc1ccc(CCN2CCC(CC2)C(O)c2cccc(OCCF)c2OC)cc1
BDBM50267556 COc1c(OCCF)cccc1C(=O)C1CCN(CCc2ccc(cc2)[N+]([O-])=O)CC1
BDBM50267557 COc1ccc(CCN2CCC(CC2)C(=O)c2cccc(OCCF)c2OC)cc1
BDBM50280055 CN1CC(CC2C1Cc1c[nH]c3cccc2c13)C(=O)N[C@]1(C)O[C@@]2(O)C3CCCN3C(=O)[C@H](Cc3ccccc3)N2C1=O
BDBM50271064 NC(=O)C(CN1CCC(CC1)c1c[nH]c2ccc(NC(=O)c3ccc(F)cc3)cc12)N1CCC(CC1)c1c[nH]c2ccc(NC(=O)c3ccc(F)cc3)cc12
BDBM50271065 CCCCCCCCN1CCC(CC1)c1c[nH]c2ccc(NC(=O)c3ccc(F)cc3)cc12
BDBM50271066 Fc1ccc(cc1)C(=O)Nc1ccc2[nH]cc(C3CCN(Cc4ccccc4)CC3)c2c1
BDBM50271067 OCCN1CCC(CC1)c1c[nH]c2ccc(NC(=O)c3ccc(F)cc3)cc12
BDBM50271068 Fc1ccc(cc1)C(=O)Nc1ccc2[nH]cc(C3CCN(CCN4CCCCC4)CC3)c2c1
BDBM50271096 CN(C)CCCN1CCC(CC1)c1c[nH]c2ccc(NC(=O)c3ccc(F)cc3)cc12
BDBM50271097 OC(=O)CCCCCCCCCN1CCC(CC1)c1c[nH]c2ccc(NC(=O)c3ccc(F)cc3)cc12
BDBM50271126 CN1CCC(CC1)c1c[nH]c2ccc(NC(=O)CC(=O)Nc3ccc4[nH]cc(C5CCN(C)CC5)c4c3)cc12
BDBM50271127 CN1CCC(CC1)c1c[nH]c2ccc(NC(=O)CCCC(=O)Nc3ccc4[nH]cc(C5CCN(C)CC5)c4c3)cc12
BDBM50271128 CN1CCC(CC1)c1c[nH]c2ccc(NC(=O)CCCCCCC(=O)Nc3ccc4[nH]cc(C5CCN(C)CC5)c4c3)cc12
BDBM50271129 CN1CCC(CC1)c1c[nH]c2ccc(NC(=O)CCCCCCCCC(=O)Nc3ccc4[nH]cc(C5CCN(C)CC5)c4c3)cc12
BDBM50271130 CN1CCC(CC1)c1c[nH]c2ccc(NC(=O)CCCCCCCCCC(=O)Nc3ccc4[nH]cc(C5CCN(C)CC5)c4c3)cc12
BDBM50271131 CN1CCC(CC1)c1c[nH]c2ccc(NC(=O)CCCCCCCCCCCC(=O)Nc3ccc4[nH]cc(C5CCN(C)CC5)c4c3)cc12
BDBM50271132 CN1CCC(CC1)c1c[nH]c2ccc(NC(=O)CCCCCCCCCCCCC(=O)Nc3ccc4[nH]cc(C5CCN(C)CC5)c4c3)cc12
BDBM50271133 CN1CCC(CC1)c1c[nH]c2ccc(NC(=O)CCCCCCCCCCCCCC(=O)Nc3ccc4[nH]cc(C5CCN(C)CC5)c4c3)cc12
BDBM50271134 CN1CCC(CC1)c1c[nH]c2ccc(NC(=O)CCCCCCCCCCCCCCC(=O)Nc3ccc4[nH]cc(C5CCN(C)CC5)c4c3)cc12
BDBM50271706 COc1ccccc1CNCCc1cc(OC)c(I)cc1OC
BDBM50271016 Fc1ccc(cc1)C(=O)Nc1ccc2[nH]cc(C3CCN(CCN4CCC(CC4)c4c[nH]c5ccc(NC(=O)c6ccc(F)cc6)cc45)CC3)c2c1
BDBM50271017 Fc1ccc(cc1)C(=O)Nc1ccc2[nH]cc(C3CCN(CCCN4CCC(CC4)c4c[nH]c5ccc(NC(=O)c6ccc(F)cc6)cc45)CC3)c2c1
BDBM50271018 Fc1ccc(cc1)C(=O)Nc1ccc2[nH]cc(C3CCN(CCCCCCN4CCC(CC4)c4c[nH]c5ccc(NC(=O)c6ccc(F)cc6)cc45)CC3)c2c1
BDBM50271019 Fc1ccc(cc1)C(=O)Nc1ccc2[nH]cc(C3CCN(CCCCCCCN4CCC(CC4)c4c[nH]c5ccc(NC(=O)c6ccc(F)cc6)cc45)CC3)c2c1
BDBM50271020 Fc1ccc(cc1)C(=O)Nc1ccc2[nH]cc(C3CCN(CCCCCCCCCN4CCC(CC4)c4c[nH]c5ccc(NC(=O)c6ccc(F)cc6)cc45)CC3)c2c1
BDBM50271021 Fc1ccc(cc1)C(=O)Nc1ccc2[nH]cc(C3CCN(CCCCCCCCCCN4CCC(CC4)c4c[nH]c5ccc(NC(=O)c6ccc(F)cc6)cc45)CC3)c2c1
BDBM50271022 Fc1ccc(cc1)C(=O)Nc1ccc2[nH]cc(C3CCN(CCCCCCCCCCCN4CCC(CC4)c4c[nH]c5ccc(NC(=O)c6ccc(F)cc6)cc45)CC3)c2c1
BDBM50271023 Fc1ccc(cc1)C(=O)Nc1ccc2[nH]cc(C3CCN(CCCCCCCCCCCCN4CCC(CC4)c4c[nH]c5ccc(NC(=O)c6ccc(F)cc6)cc45)CC3)c2c1
BDBM50271024 Fc1ccc(cc1)C(=O)Nc1ccc2[nH]cc(C3CCN(CCOCCOCCN4CCC(CC4)c4c[nH]c5ccc(NC(=O)c6ccc(F)cc6)cc45)CC3)c2c1
BDBM50271025 Fc1ccc(cc1)C(=O)Nc1ccc2[nH]cc(C3CCN(CCOCCOCCOCCN4CCC(CC4)c4c[nH]c5ccc(NC(=O)c6ccc(F)cc6)cc45)CC3)c2c1
BDBM50271061 Fc1ccc(cc1)C(=O)Nc1ccc2[nH]cc(C3CCN(C\C=C\CN4CCC(CC4)c4c[nH]c5ccc(NC(=O)c6ccc(F)cc6)cc45)CC3)c2c1
BDBM50271062 Fc1ccc(cc1)C(=O)Nc1ccc2[nH]cc(C3CCN(Cc4cccc(CN5CCC(CC5)c5c[nH]c6ccc(NC(=O)c7ccc(F)cc7)cc56)c4)CC3)c2c1
BDBM50271135 CN1CCC(CC1)c1c[nH]c2ccc(N)cc12
BDBM50271063 Fc1ccc(cc1)C(=O)Nc1ccc2[nH]cc(C3CCN(CC(N4CCC(CC4)c4c[nH]c5ccc(NC(=O)c6ccc(F)cc6)cc45)C(F)(F)F)CC3)c2c1
BDBM50290912 COc1ccc(NC(=O)N2CCN(CC2)c2ccc(C)cc2C)cc1N1CCN(C)CC1
BDBM50290913 COc1ccc(NCC(=O)N2CCN(CC2)c2ccccc2C)cc1N1CCN(C)CC1
BDBM50290914 COc1ccc(NC(=O)N2CCN(CC2)c2ccccc2C)cc1N1CCN(C)CC1
BDBM50290915 COc1ccc(NC(=O)N2CCN(CC2)c2c(C)cccc2C)cc1N1CCN(C)CC1
BDBM50290916 CN1CCN(CC1)c1cc(OC(=O)N2CCN(CC2)c2ccccc2C)ccc1Cl
BDBM50290918 COc1cccc(c1)N1CCN(CC1)C(=O)Nc1ccc(OC)c(c1)N1CCN(C)CC1
BDBM50290919 COc1ccc(cc1)N1CCN(CC1)C(=O)Nc1ccc(OC)c(c1)N1CCN(C)CC1
BDBM50290921 COc1ccc(NC(=O)N2CCN(CC2)c2cccc3CCCCc23)cc1N1CCN(C)CC1
BDBM50290922 COc1ccc(NC(=O)N2CCN(CC2)c2ccccc2)cc1N1CCN(C)CC1
BDBM50290923 CN1CCN(CC1)c1cc(OCC(=O)N2CCN(CC2)c2ccccc2C)ccc1Cl
BDBM50288954 OC12C3C4C5C3C(C3C5CC4C13)N2Cc1ccccc1 |TLB:3:2:12:11.7,4:5:12:11.7,10:11:12:2.5,8:7:12:2.5,THB:13:12:11.7:2.5|
BDBM50304075 CN(C)Cc1nc(-c2ccc(cc2)C(C)(C)C)n(n1)-c1cccc(O)c1
BDBM50306587 COC1(CCOCC1)c1ccc(NC(=O)c2cc(=O)c3cc(F)cc(-c4c(C)nn(C)c4C)c3o2)cn1 |(27.97,-16.65,;26.65,-17.44,;26.66,-18.99,;26.66,-20.53,;27.99,-21.29,;29.33,-20.52,;29.33,-18.98,;27.99,-18.21,;25.33,-18.23,;24,-19,;22.66,-18.23,;22.67,-16.69,;21.33,-15.93,;20,-16.7,;20,-18.24,;18.66,-15.93,;18.66,-14.39,;17.31,-13.61,;17.31,-12.07,;15.98,-14.4,;14.65,-13.63,;13.32,-14.4,;11.99,-13.63,;13.32,-15.95,;14.65,-16.72,;14.65,-18.27,;15.9,-19.17,;17.36,-18.7,;15.42,-20.64,;13.88,-20.64,;12.98,-21.89,;13.41,-19.17,;11.94,-18.7,;15.99,-15.94,;17.33,-16.71,;23.99,-15.92,;25.32,-16.68,)|
BDBM50306588 CCC(=O)N1CCN(CC1)c1ccc(NC(=O)c2cc(=O)c3cc(F)cc(N4CCN(C)CC4)c3o2)cc1
BDBM50306589 COc1cc2CC[C@@H](Oc2c(c1)N1CCN(C)CC1)C(=O)Nc1ccc(cc1)N1CCOCC1 |r|
BDBM50306590 Cc1n[nH]c(C)c1-c1ccc(C)c2c(O)cc(nc12)C(=O)Nc1ccc(cc1)N1CCOCC1 |(-3.14,-20.26,;-4.6,-20.73,;-5.08,-22.2,;-6.62,-22.2,;-7.1,-20.74,;-8.56,-20.26,;-5.85,-19.83,;-5.85,-18.28,;-7.18,-17.51,;-7.18,-15.97,;-5.85,-15.2,;-5.86,-13.66,;-4.52,-15.96,;-3.19,-15.18,;-3.2,-13.64,;-1.84,-15.95,;-1.84,-17.5,;-3.17,-18.27,;-4.51,-17.51,;-.5,-18.26,;-.5,-19.8,;.83,-17.49,;2.16,-18.25,;2.16,-19.8,;3.5,-20.56,;4.83,-19.79,;4.82,-18.24,;3.48,-17.48,;6.17,-20.55,;6.16,-22.09,;7.49,-22.85,;8.83,-22.08,;8.82,-20.54,;7.49,-19.77,)|
BDBM50306591 COC1(CCOCC1)c1ccc(NC(=O)C2CCc3cc(F)cc(-c4c(C)nn(C)c4C)c3O2)cn1 |(8.7,-32.23,;7.37,-33.01,;7.39,-34.56,;7.39,-36.1,;8.72,-36.86,;10.06,-36.09,;10.05,-34.55,;8.71,-33.78,;6.06,-33.8,;4.72,-34.57,;3.39,-33.8,;3.39,-32.26,;2.06,-31.5,;.73,-32.27,;.73,-33.81,;-.61,-31.5,;-.62,-29.96,;-1.96,-29.19,;-3.29,-29.97,;-4.62,-29.2,;-5.95,-29.98,;-7.29,-29.21,;-5.95,-31.52,;-4.62,-32.29,;-4.62,-33.84,;-3.38,-34.74,;-1.91,-34.27,;-3.85,-36.21,;-5.39,-36.21,;-6.3,-37.46,;-5.87,-34.75,;-7.33,-34.27,;-3.28,-31.52,;-1.94,-32.28,;4.71,-31.49,;6.05,-32.25,)|
BDBM50308182 N[C@@H]1CCN(C1)c1ccc2[nH]nc(c2c1)S(=O)(=O)c1cccc2ccccc12 |r|
BDBM50327860 CCCCN1CCC(COC(=O)c2cc(Cl)c(NC)c3OCCOc23)CC1
BDBM50327861 CCCCN1CCC(COC(=O)c2ccc(N)c(OC)c2)CC1
BDBM50327863 CCCCN1CCC(COC(=O)c2cc(F)c(N)c3OCCOc23)CC1
BDBM50328477 CN1CCC(CC1)c1cn(-c2ccc(F)cc2)c2ccc(cc12)-c1cncnc1
BDBM50327234 CCCCOc1ccc(cc1)-c1nn2c(C)cc(C)nc2c1CC(=O)N(CC)CC
BDBM50327235 CCN(CC)C(=O)Cc1c(nn2c(C)cc(C)nc12)-c1ccc(OCC#C)cc1
BDBM50327236 CCCOc1ccc(cc1)-c1nn2c(C)cc(C)nc2c1CC(=O)N(CC)CC
BDBM50327237 CCOc1ccc(cc1)-c1nn2c(C)cc(C)nc2c1CC(=O)N(CC)CC
BDBM50326218 O=C(Cc1ccccc1)NC1CCN(CCCN2C(=O)COc3ccccc23)CC1
BDBM50326219 CCCCC1CCN(CCCC(=O)c2ccccc2C)CC1
BDBM50330511 CN1CCN(CC1)c1ccc2[nH]nc(c2c1)S(=O)(=O)c1cccc2ccccc12
BDBM50330512 O=S(=O)(c1n[nH]c2ccc(cc12)N1CCNCC1)c1cccc2ccccc12
BDBM50330516 Cn1nc(c2cc(ccc12)N1CCNCC1)S(=O)(=O)c1cccc2ccccc12
BDBM50330522 CC(C)n1nc(c2cc(ccc12)N1CCNCC1)S(=O)(=O)c1cccc2ccccc12
BDBM50330524 CC(C)Cn1nc(c2cc(ccc12)N1CCNCC1)S(=O)(=O)c1cccc2ccccc12
BDBM50330526 O=S(=O)(c1nn(Cc2ccccc2)c2ccc(cc12)N1CCNCC1)c1cccc2ccccc12
BDBM50330533 CN1CCN(CC1)c1ccc2[nH]nc(c2c1)S(=O)(=O)c1ccccc1
BDBM50336843 Fc1nc(cs1)C#Cc1cc(F)cc(c1)C#N
BDBM50330813 CN(C)[C@@H]1CC[C@@H](C1)c1c[nH]c2ccc(cc12)C#N |r|
BDBM50330814 CN(C)[C@H]1CC[C@H](C1)c1c[nH]c2ccc(F)cc12 |r|
BDBM50343890 COc1ccccc1N1CCN(CCN(C(=O)C23C4C5C2C2C3C4C52I)c2ccccn2)CC1 |(-6.86,-9.06,;-6.09,-10.39,;-6.85,-11.73,;-8.4,-11.74,;-9.16,-13.07,;-8.38,-14.4,;-6.84,-14.4,;-6.07,-13.06,;-4.53,-13.06,;-3.77,-14.39,;-2.23,-14.39,;-1.46,-13.06,;.08,-13.06,;.85,-11.73,;2.39,-11.73,;3.16,-10.4,;4.7,-10.4,;2.39,-9.07,;.46,-8.94,;.71,-7.01,;2.65,-7.12,;2.13,-6.61,;1.89,-8.55,;-.05,-8.43,;.21,-6.48,;-.77,-5.3,;3.16,-13.07,;4.68,-13.06,;5.45,-14.4,;4.67,-15.73,;3.14,-15.72,;2.37,-14.39,;-2.23,-11.73,;-3.78,-11.73,)|
BDBM50343894 Oc1ccccc1N1CCN(CCN(C(=O)C23C4C5C2C2C3C4C52I)c2ccccn2)CC1 |(16.06,-35.05,;15.3,-36.38,;13.75,-36.39,;12.99,-37.73,;13.77,-39.05,;15.31,-39.05,;16.08,-37.72,;17.61,-37.71,;18.38,-39.05,;19.91,-39.05,;20.69,-37.72,;22.22,-37.72,;22.99,-36.39,;24.53,-36.39,;25.3,-35.06,;26.84,-35.06,;24.54,-33.72,;22.6,-33.6,;22.86,-31.67,;24.8,-31.78,;24.28,-31.26,;24.04,-33.21,;22.1,-33.08,;22.36,-31.14,;21.37,-29.96,;25.3,-37.72,;26.83,-37.71,;27.6,-39.06,;26.82,-40.39,;25.28,-40.38,;24.52,-39.05,;19.91,-36.38,;18.37,-36.38,)|
BDBM50334720 NCCC(=O)Nc1ccc2[nH]nc(c2c1)S(=O)(=O)c1cccc2ccccc12
BDBM50334725 O=C(Nc1ccc2[nH]nc(c2c1)S(=O)(=O)c1cccc2ccccc12)C1CCNCC1
BDBM50334731 O=S(=O)(c1n[nH]c2ccc(NC3CCNCC3)cc12)c1cccc2ccccc12
BDBM50334732 Clc1cccc(c1)S(=O)(=O)c1n[nH]c2ccc(NC3CCNCC3)cc12
BDBM50334733 CC(C)c1ccc(cc1)S(=O)(=O)c1n[nH]c2ccc(NC3CCNCC3)cc12
BDBM50334734 O=S(=O)(c1n[nH]c2ccc(NC3CCNCC3)cc12)c1ccc2ccccc2c1
BDBM50355990 Cc1nnc([nH]1)-c1ccc(C)c(c1)-c1ccc2c(NC(=O)C22CCOCC2)c1
BDBM50356277 COc1ccc(NC(=O)c2ccc3N(CC(=O)N(C)c3c2)c2ccc(Cl)c(Cl)c2)cc1N1CCN(C)CC1
BDBM50383117 C[C@@H]1CCCN1CCc1cc2cc(ccc2o1)C(=O)c1ccc(cc1)[N+]([O-])=O |r|
BDBM50366923 CCN(C)C1CCCc2ccncc12
BDBM50366907 NC(=O)c1ccc2[C@H](CCN3CCC(=CC3)c3c[nH]c4c(F)cccc34)OCCc2c1 |r,c:13|
BDBM50378386 CC1(C)NC(Nc2cccc(Br)c2)=NC(N)=N1 |c:13,16|
BDBM50369019 CN(C)[C@@H]1CCc2ccc3[nH]cc(C=O)c3c2C1 |r|
BDBM50369016 CCCN(CCCCN1C(=O)CC(C)(C)CC1=O)[C@@H]1CCc2ccc3[nH]cc(C=O)c3c2C1 |r|
BDBM50369018 CCCN(CC(C)C)[C@@H]1CCc2ccc3[nH]ccc3c2C1 |r|
BDBM50369022 CCCN(CCCc1ccccc1)[C@@H]1CCc2ccc3[nH]cc(C=O)c3c2C1 |r|
BDBM50399614 CCCN1CCC(COc2nc3c(F)cccc3c3ncccc23)CC1
BDBM50399615 CCCN1CCC(COc2nc3ccccc3c3ncccc23)CC1
BDBM50399616 CCCN1CCC(COc2nc3c(Cl)cccc3c3ccccc23)CC1
BDBM50399619 CCCN1CCC(COc2nc3c(F)cccc3c3ccccc23)CC1
BDBM50399620 CCCN1CCC(COc2nc3c(OC)cccc3c3ccccc23)CC1
BDBM50399621 Fc1cccc2c1nc(OCC1CCN(CCCc3ccc(I)cc3)CC1)c1cccnc21
BDBM50399622 CCCN1CCC(COc2nc3c(I)cccc3c3ncccc23)CC1
BDBM50399623 CCCN1CCC(COc2nc3c(I)cccc3c3ccccc23)CC1
BDBM50408700 COc1ccc(NC(=O)c2ccc(cc2)-c2ccc(cc2C)-c2noc(C)n2)cc1NCCN(C)C
BDBM50408701 CN(C)CCOc1cc(NC(=O)c2ccc(cc2)-c2ccc(cc2C)-c2noc(C)n2)cc2CCOc12
BDBM50408702 COc1ccc(NC(=O)c2ccc(cc2)-c2ccc(cc2C)-c2noc(C)n2)cc1CCCN(C)C
BDBM50408703 COc1ccc(NC(=O)c2ccc(Br)c(C)c2)cc1N1CCN(C)CC1
BDBM50408704 COc1cc2CCN(C(=O)c3ccc(cc3)-c3ccc(cc3C)-c3noc(C)n3)c2cc1OCCN(C)C
BDBM50408705 CN(C)CCN1CCOc2ccc(NC(=O)c3ccc(cc3)-c3ccc(cc3C)-c3noc(C)n3)cc12
BDBM50408706 CN1CCN(CC1)c1cc(NC(=O)c2ccc(Br)c(C)c2)ccc1C
BDBM50408707 CN1CCN(CC1)c1cccc(NC(=O)c2ccc(Br)c(C)c2)c1
BDBM50408829 CC(C)n1cc2C[C@H]3N(C)C[C@H](CO)C=C3c3cccc1c23 |c:14|
BDBM50408833 CC(C)n1cc2C[C@@H]3[C@H](C=C(CO)CN3C)c3cccc1c23 |t:9|
BDBM50408847 CC(C)n1cc2C[C@@H]3[C@H](C[C@@H](CO)CN3C)c3cccc1c23
BDBM50401358 OC12C3C4C5C3C(C3C5CC4C13)N2CCc1cccnc1 |TLB:6:7:4.3:9,8:7:5.2:12,4:5:7.11:12,1:11:4.3:9,10:11:5.2:12,3:2:7.11:12,THB:5:4:7.11:9,2:3:7.11:9,13:12:5.2:7.11|
BDBM50401359 OC12C3C4C5C3C(C3C5CC4C13)N2CCc1ccccn1 |TLB:6:7:4.3:9,8:7:5.2:12,4:5:7.11:12,1:11:4.3:9,10:11:5.2:12,3:2:7.11:12,THB:5:4:7.11:9,2:3:7.11:9,13:12:5.2:7.11|
BDBM50401361 COc1cccc(CCN2C3C4C5C6C4C2(O)C2C6CC5C32)c1 |TLB:10:21:12.13:19,15:17:12.13:19,THB:11:12:21.17:19,20:21:11.14:9,12:11:21.17:9,14:13:21.17:19,18:17:11.14:9,13:14:21.17:9,8:9:11.14:21.17|
BDBM50401375 COc1ccc(CCN2C3C4C5C6C4C2(O)C2C6CC5C32)cc1OC |TLB:9:20:11.12:18,14:16:11.12:18,THB:10:11:20.16:18,19:20:10.13:8,11:10:20.16:8,13:12:20.16:18,17:16:10.13:8,12:13:20.16:8,7:8:10.13:20.16|
BDBM50401376 COc1ccc(CCN2C3C4C5C6C4C2(O)C2C6CC5C32)cc1 |TLB:9:20:11.12:18,14:16:11.12:18,THB:10:11:20.16:18,19:20:10.13:8,11:10:20.16:8,13:12:20.16:18,17:16:10.13:8,12:13:20.16:8,7:8:10.13:20.16|
BDBM50401382 COc1ccc(CN2C3C4C5C6C4C2(O)C2C6CC5C32)cc1 |TLB:8:19:10.11:17,13:15:10.11:17,THB:9:10:19.15:17,18:19:9.12:7,10:9:19.15:7,12:11:19.15:17,16:15:9.12:7,11:12:19.15:7,6:7:9.12:19.15|
BDBM50400902 Cc1ccc(Sc2ccccc2N2CCNCC2)c(C)c1
BDBM50403826 COc1ccc(cc1N1CCNCC1)S(=O)(=O)Nc1cc(Br)ccc1Br
BDBM50403827 COc1ccc(cc1N1CCNCC1)S(=O)(=O)N1CCc2ccc(I)cc12
BDBM50403833 COc1ccc(cc1N1CCNCC1)S(=O)(=O)Nc1cc(Cl)cc(Cl)c1Cl
BDBM50403897 CN(C)CCO\N=C1\c2cccn2-c2c(C)csc12
BDBM50410435 CN1CCN(CC1)c1cc2N(CCc2cc1Cl)C(=O)Nc1ccc(-c2ccncc2)c2ccccc12
BDBM50410436 CCc1c(cnn1-c1ccc(cc1)C#N)C(=O)N1CCc2cc3ccnc(N4CCN5CCC[C@H]5C4)c3cc12
BDBM50410437 CN1CCN(CC1)c1nccc2cc3CCN(C(=O)c4cccc5ncccc45)c3cc12
BDBM50410438 CN1CCN(CC1)c1nccc2cc3CCN(C(=O)c4cnn(C)c4C(F)(F)F)c3cc12
BDBM50410439 CN1CCN(CC1)c1nccc2cc3CCN(C(=O)c4cc(C)oc4C(F)(F)F)c3cc12
BDBM50410440 CN1CCN(CC1)c1nccc2cc3CCN(C(=O)c4cnn(c4C)-c4ccccc4)c3cc12
BDBM50410441 CN1CCN(CC1)c1nccc2cc3CCN(C(=O)c4oc(C)nc4C)c3cc12
BDBM50410442 CN1CCN(CC1)c1nccc2cc3CCN(C(=O)c4ccccc4C(F)(F)F)c3cc12
BDBM50410424 CN1CCN(CC1)c1nccc2cc3CCN(C(=O)c4ccc(nc4)C(F)(F)F)c3cc12
BDBM50410425 CCc1c(cnn1-c1ccc(cc1)C#N)C(=O)N1CCc2cc3ccnc(N4CCN(CC4)C(C)C)c3cc12
BDBM50410426 CN1CCN(CC1)c1nccc2cc3CCN(C(=O)c4ccc(Cl)cc4)c3cc12
BDBM50410427 CN1CCN(CC1)c1nccc2cc3CCN(C(=O)c4ccc(cc4)C#N)c3cc12
BDBM50410428 CN1CCN(CC1)c1nccc2cc3CCN(C(=O)c4cnn5ccccc45)c3cc12
BDBM50410429 CN1CCN(CC1)c1nccc2cc3CCN(C(=O)c4ccccc4Cl)c3cc12
BDBM50410430 CCc1c(cnn1-c1ccc(cc1)C#N)C(=O)N1CCc2cc3ccnc(N4CCN(C)CC4)c3cc12
BDBM50410431 CCc1c(cnn1-c1ccc(cc1)C#N)C(=O)N1CCc2cc3ccnc(N4C[C@H](C)N[C@H](C)C4)c3cc12
BDBM50410432 CCc1c(cnn1-c1ccc(cc1)C#N)C(=O)N1CCc2cc3ccnc(N4CCN5CCC[C@@H]5C4)c3cc12
BDBM50410433 CCN1CCN(CC1)c1nccc2cc3CCN(C(=O)c4cnn(c4CC)-c4ccc(cc4)C#N)c3cc12
BDBM50410434 CCc1c(cnn1-c1ccc(cc1)C#N)C(=O)N1CCc2cc3ccnc(N4CCNCC4)c3cc12
BDBM50413687 C[C@H]1CN(C[C@@H](C)N1)c1cccc(CC2CCN(CCOc3cccc4nc(C)ccc34)CC2)c1 |r|
BDBM50413688 C[C@@H]1CN(CCN1)c1cccc(CC2CCN(CCOc3cccc4nc(C)ccc34)CC2)c1 |r|
BDBM50413689 C[C@H]1CN(CCN1)c1cccc(CC2CCN(CCOc3cccc4nc(C)ccc34)CC2)c1 |r|
BDBM50413690 C[C@@H]1CN([C@@H](C)CN1)c1cccc(CC2CCN(CCOc3cccc4nc(C)ccc34)CC2)c1 |r|
BDBM50413691 CN1CCN(CC1)c1cccc(CC2CCN(CCOc3cccc4nc(C)ccc34)CC2)c1
BDBM50413692 CN1CCN(CC1=O)c1cccc(CC2CCN(CCOc3cccc4nc(C)ccc34)CC2)c1
BDBM50413693 CN1CCN(C(=O)C1)c1cccc(CC2CCN(CCOc3cccc4nc(C)ccc34)CC2)c1
BDBM50413694 Cc1ccc2c(OCCN3CCC(Cc4cccc(c4)N4CCCCC4)CC3)cccc2n1
BDBM50413695 C[C@H]1CN(C[C@@H](C)O1)c1cccc(CC2CCN(CCOc3cccc4nc(C)ccc34)CC2)c1 |r|
BDBM50413696 CN1CCCN(CC1)c1cccc(CC2CCN(CCOc3cccc4nc(C)ccc34)CC2)c1
BDBM50413697 Cc1ccc2c(OCCN3CCC(Cc4cccc(c4)N4CCCC4)CC3)cccc2n1
BDBM50413698 CN1CCC(CC1)c1cccc(CC2CCN(CCOc3cccc4nc(C)ccc34)CC2)c1
BDBM50413699 Cc1ccc2c(OCCN3CCC(Cc4cccc(c4)C4CCNCC4)CC3)cccc2n1
BDBM50413700 CC(=O)N1CCC(CC1)c1cccc(CC2CCN(CCOc3cccc4nc(C)ccc34)CC2)c1
BDBM50413701 Cc1ccc2c(OCCN3CCC(Cc4cccc(c4)C4CCN(CC4)S(C)(=O)=O)CC3)cccc2n1
BDBM50413702 Cc1ccc2c(OCCN3CCC(Cc4cccc(c4)-c4ccncc4)CC3)cccc2n1
BDBM50413703 Cc1ccc2c(OCCN3CCC(Cc4cccc(c4)-c4cccnc4)CC3)cccc2n1
BDBM50413704 Cc1ccc2c(OCCN3CCC(Cc4cccc(c4)-c4ccccc4)CC3)cccc2n1
BDBM50413705 Cc1ccc2c(OCCN3CCC(Cc4cccc(c4)-c4ccoc4)CC3)cccc2n1
BDBM50413706 Cc1ccc2c(OCCN3CCC(Cc4cccc(c4)N4CCOCC4)CC3)cccc2n1
BDBM50413549 Cc1ccc2c(cccc2n1)N1CCN(CCc2cccc3NC(=O)COc23)CC1
BDBM50413550 CN1C(=O)COc2c(CCN3CCN(CC3)c3cccc4nc(C)ccc34)cccc12
BDBM50413551 Cc1ccc2c(cccc2n1)N1CCN(CCc2ccc3NC(=O)COc3c2)CC1
BDBM50413552 CN1C(=O)COc2cc(CCN3CCN(CC3)c3cccc4nc(C)ccc34)ccc12
BDBM50413553 CCN1C(=O)COc2c(CCN3CCN(CC3)c3cccc4nc(C)ccc34)cccc12
BDBM50413554 CC(C)N1C(=O)COc2c(CCN3CCN(CC3)c3cccc4nc(C)ccc34)cccc12
BDBM50413555 Cc1ccc2c(cccc2n1)N1CCN(CCc2cccc3N(C4CC4)C(=O)COc23)CC1
BDBM50413556 Cc1ccc2c(cccc2n1)N1CCN(CCc2cccc3N(CC4CC4)C(=O)COc23)CC1
BDBM50413557 Cc1ccc2c(cccc2n1)N1CCN(CCc2cccc3N(CC(F)F)C(=O)COc23)CC1
BDBM50413558 C[C@@H]1CN(CCN1CCc1cccc2N(C)C(=O)COc12)c1cccc2nc(C)ccc12 |r|
BDBM50413559 C[C@H]1CN(CCN1CCc1cccc2N(C)C(=O)COc12)c1cccc2nc(C)ccc12 |r|
BDBM50413560 CN1C(=O)COc2c(CCN3CCN(CC3)c3cc(F)cc4nc(C)ccc34)cccc12
BDBM50413561 C[C@@H]1CN(CCN1CCc1cccc2N(C)C(=O)COc12)c1cc(F)cc2nc(C)ccc12 |r|
BDBM50413562 CN1C(=O)COc2c(CCCN3CCN(CC3)c3cccc4nc(C)ccc34)cccc12
BDBM50413563 C[C@@H]1CN(CCN1CCCc1cccc2N(C)C(=O)COc12)c1cccc2nc(C)ccc12 |r|
BDBM50413564 CN1C(=O)COc2c(CCCN3CCN(CC3)c3cc(F)cc4nc(C)ccc34)cccc12
BDBM50413565 C[C@@H]1CN(CCN1CCCc1cccc2N(C)C(=O)COc12)c1cc(F)cc2nc(C)ccc12 |r|
BDBM50413566 Cc1ccc2c(cccc2n1)N1CCN(CCCc2cccc3NC(=O)COc23)CC1
BDBM50417409 CN1C(=O)CCc2c(CCN3CCN(CC3)c3cccc4nc(C)ccc34)cccc12
BDBM50417410 Cc1ccc2c(cccc2n1)N1CCN(CCc2c(C)ccc3NC(=O)CCc23)CC1
BDBM50417411 Cc1ccc2c(cccc2n1)N1CCN(CCc2cccc3[nH]c(=O)ccc23)CC1
BDBM50417412 Cc1ccc2c(cccc2n1)N1CCN(CCc2c(C)ccc3[nH]c(=O)ccc23)CC1
BDBM50417413 Cc1ccc2c(cccc2n1)N1CCN(CCc2c(F)ccc3n(C)c(=O)ccc23)CC1
BDBM50417414 Cc1ccc2c(cc(F)cc2n1)N1CCN(CCc2c(C)ccc3n(C)c(=O)ccc23)CC1
BDBM50417415 C[C@@H]1CN(CCN1CCc1c(C)ccc2n(C)c(=O)ccc12)c1cccc2nc(C)ccc12 |r|
BDBM50417416 C[C@H]1CN(CCN1CCc1cccc2n(C)c(=O)ccc12)c1cccc2nc(C)ccc12 |r|
BDBM50417417 C[C@H]1CN(CCN1CCc1c(C)ccc2n(C)c(=O)ccc12)c1cccc2nc(C)ccc12 |r|
BDBM50417418 C[C@H]1CN(CCN1CCc1c(C)ccc2n(C)c(=O)ccc12)c1cc(F)cc2nc(C)ccc12 |r|
BDBM50417419 Cc1ccc2c(cccc2n1)N1CCN(CCc2cccc3n(C)c(=O)ccc23)C(C)(C)C1
BDBM50417420 Cc1ccc2c(cccc2n1)N1CCN(CCc2cccc3NC(=O)CCc23)CC1
BDBM50417421 CN1C(=O)CCc2c(CCN3CCN(CC3)c3cccc4nc(C)ccc34)c(C)ccc12
BDBM50417422 Cc1ccc2c(cccc2n1)N1CCN(CCc2c(C)ccc3n(C)c(=O)ccc23)CC1
BDBM50417423 Cc1ccc2c(cccc2n1)N1CCN(CCc2c(Cl)ccc3n(C)c(=O)ccc23)CC1
BDBM50417424 C[C@@H]1CN(CCN1CCc1cccc2n(C)c(=O)ccc12)c1cc(F)cc2nc(C)ccc12 |r|
BDBM50417425 C[C@H]1CN(CCN1CCc1cccc2n(C)c(=O)ccc12)c1cc(F)cc2nc(C)ccc12 |r|
BDBM50417426 Cc1ccc2c(cccc2n1)C1CCN(CCc2c(C)ccc3n(C)c(=O)ccc23)CC1
BDBM50417427 Cc1ccc2c(cccc2n1)N1CCN(CCc2cccc3n(C)c(=O)ccc23)CC1
BDBM50413069 Cc1ccc2c(cccc2n1)N1C[C@H]2C[C@@H]1CN2CCc1ccc2OCC(=O)Nc2c1 |r|
BDBM50413070 CC1CN(CCc2ccc3OCC(=O)Nc3c2)CCN1c1cccc2nc(C)ccc12
BDBM50413071 C[C@@H]1CN(CCN1CCc1ccc2OCC(=O)Nc2c1)c1cccc2nc(C)ccc12 |r|
BDBM50413072 C[C@H]1CN(CCN1CCc1ccc2OCC(=O)Nc2c1)c1cccc2nc(C)ccc12 |r|
BDBM50413073 Cc1ccc2c(cccc2n1)N1CCN(CCc2ccc3OCC(=O)Nc3c2F)CC1
BDBM50413074 Cc1ccc2c(cccc2n1)N1CCN(CCc2cc3NC(=O)COc3cc2F)CC1
BDBM50413075 Cc1ccc2c(cccc2n1)N1CCN(CCc2cc(F)c3OCC(=O)Nc3c2)CC1
BDBM50413076 CCN1C(=O)COc2ccc(CCN3CCN(CC3)c3cccc4nc(C)ccc34)cc12
BDBM50413077 CN1C(=O)COc2ccc(CCN3CCN(CC3)c3cccc4nc(C)ccc34)cc12
BDBM50413078 CC1(C)Cc2cccc(N3CCN(CCc4ccc5OCC(=O)Nc5c4)CC3)c2O1
BDBM50413079 Cc1cc2c(cccc2[nH]1)N1CCN(CCc2ccc3OCC(=O)Nc3c2)CC1
BDBM50413080 Cc1ncc2c(cccc2n1)N1CCN(CCc2ccc3OCC(=O)Nc3c2)CC1
BDBM50413081 O=C1COc2ccc(CCN3CCN(CC3)c3cccc4cccnc34)cc2N1
BDBM50413082 O=C1COc2ccc(CCN3CCN(CC3)c3nccc4ccccc34)cc2N1
BDBM50413083 O=C1COc2ccc(CCN3CCN(CC3)c3cccc4nc(ccc34)-c3ccccc3)cc2N1
BDBM50413084 Cc1ccc2c(cc(Cl)cc2n1)N1CCN(CCc2ccc3OCC(=O)Nc3c2)CC1
BDBM50413085 Cc1ccc2c(cc(F)cc2n1)N1CCN(CCc2ccc3OCC(=O)Nc3c2)CC1
BDBM50413086 Cc1cc(N2CCN(CCc3ccc4OCC(=O)Nc4c3)CC2)c2ccc(C)nc2c1
BDBM50413087 Cc1ccc2c(ccc(Cl)c2n1)N1CCN(CCc2ccc3OCC(=O)Nc3c2)CC1
BDBM50412983 Clc1c(cnn(Cc2cccc(NC(=O)c3ccc(cc3)-c3ccccc3)c2)c1=O)N1CCNCC1
BDBM50412984 Cc1ccc(Cn2ncc(N3CCNCC3)c(Cl)c2=O)cc1NC(=O)c1ccc(cc1)-c1ccccc1
BDBM50412985 Cc1c(Cn2ncc(N3CCNCC3)c(Cl)c2=O)cccc1NC(=O)c1ccc(cc1)-c1ccccc1
BDBM50412114 Cc1ccc2c(OCCN3CCC(Cc4ccc5OCC(=O)Nc5c4)CC3)cccc2n1
BDBM50412115 CC(=O)Nc1ccc(CN2CCN(CCOc3cccc4nc(C)ccc34)CC2)cc1
BDBM50412116 COc1cccc(CN2CCN(CCOc3cccc4nc(C)ccc34)CC2)c1
BDBM50412117 COc1ccc(CN2CCN(CCOc3cccc4nc(C)ccc34)CC2)cc1
BDBM50412118 CC(=O)Nc1cccc(CN2CCN(CCOc3cccc4nc(C)ccc34)CC2)c1
BDBM50412119 Cc1ccc2c(OCCN3CCN(Cc4ccccc4)CC3)cccc2n1
BDBM50412120 Cc1ccc2c(OCCN3CCN(Cc4cccc5cccnc45)CC3)cccc2n1
BDBM50412121 CN(C(C)=O)c1cccc(CN2CCN(CCOc3cccc4nc(C)ccc34)CC2)c1
BDBM50412122 CC(=O)Nc1ccccc1CN1CCN(CCOc2cccc3nc(C)ccc23)CC1
BDBM50412123 COc1ccc(CC2CCN(CCOc3cccc4nc(C)ccc34)CC2)cc1NS(C)(=O)=O
BDBM50412124 CC(C)S(=O)(=O)Nc1cccc(CC2CCN(CCOc3cccc4nc(C)ccc34)CC2)c1
BDBM50412125 CN(c1cccc(CC2CCN(CCOc3cccc4nc(C)ccc34)CC2)c1)S(C)(=O)=O
BDBM50412126 CCNC(=O)Nc1cccc(CC2CCN(CCOc3cccc4nc(C)ccc34)CC2)c1
BDBM50412127 CN(C)CC(=O)Nc1cccc(CC2CCN(CCOc3cccc4nc(C)ccc34)CC2)c1
BDBM50412128 CCN(C(C)=O)c1cccc(CC2CCN(CCOc3cccc4nc(C)ccc34)CC2)c1
BDBM50412129 CC(C)C(=O)Nc1cccc(CC2CCN(CCOc3cccc4nc(C)ccc34)CC2)c1
BDBM50412130 CCC(=O)Nc1cccc(CC2CCN(CCOc3cccc4nc(C)ccc34)CC2)c1
BDBM50412131 Cc1ccc2c(OCCN3CCC(Cc4cccc(c4)N4CCCS4(=O)=O)CC3)cccc2n1
BDBM50412132 Cc1ccc2c(OCCN3CCC(Cc4cccc(NS(C)(=O)=O)c4)CC3)cccc2n1
BDBM50412133 CN(C(C)=O)c1cccc(CC2CCN(CCOc3cccc4nc(C)ccc34)CC2)c1
BDBM50412134 CC(=O)Nc1cccc(CC2CCN(CCOc3cccc4nc(C)ccc34)CC2)c1
BDBM50412135 Cc1ccc2c(OCCN3CCC(Cc4cccc(c4)N4CCCC4=O)CC3)cccc2n1
BDBM50412433 Cc1ccc2c(OCCCN3CC(COc4ccc5OCC(=O)Nc5c4)C3)cccc2n1
BDBM50412434 Cc1ccc2c(cccc2n1)N1CCN(CCCCc2ccc3OCC(=O)Nc3c2)CC1
BDBM50412435 CC(COc1cccc2nc(C)ccc12)N1CCC(Cc2ccc3OCC(=O)Nc3c2)CC1
BDBM50412436 Cc1ccc2c(OC3CCN(CC(=O)c4ccc5OCC(=O)Nc5c4)CC3)cccc2n1
BDBM50412437 Cc1ccc2c(OC3CCN(Cc4ccc5OCC(=O)Nc5c4)CC3)cccc2n1
BDBM50412438 Cc1ccc2c(cccc2n1)N1CCN(Cc2ccc3OCC(=O)Nc3c2)CC1
BDBM50412439 Cc1ccc2c(OCCN3CC(COc4ccc5OCC(=O)Nc5c4)C3)cccc2n1
BDBM50412440 Cc1ccc2c(cccc2n1)N1CCN(CCCc2ccc3OCC(=O)Nc3c2)CC1
BDBM50412441 Cc1ccc2c(cccc2n1)N1CCN(CCc2ccc3OCC(=O)Nc3c2)CC1
BDBM50412442 Cc1ccc2c(OCCCN3CC(C3)Oc3ccc4OCC(=O)Nc4c3)cccc2n1
BDBM50412443 CC(CN1CCC(Cc2ccc3OCC(=O)Nc3c2)CC1)Oc1cccc2nc(C)ccc12
BDBM50412444 Cc1ccc2c(OC3CCN(CCc4ccc5OCC(=O)Nc5c4)CC3)cccc2n1
BDBM50412445 Cc1ccc2c(OCC3CCN(CC(=O)c4ccc5OCC(=O)Nc5c4)CC3)cccc2n1
BDBM50412446 Cc1ccc2c(OCC3CCN(Cc4ccc5OCC(=O)Nc5c4)CC3)cccc2n1
BDBM50413068 Cc1ccc2c(ccc(F)c2n1)N1CCN(CCc2ccc3OCC(=O)Nc3c2)CC1
BDBM50421370 CCCN(CCCCN1C(=O)CC2(CCCC2)CC1=O)CC1COc2cccc(OC)c2C1
BDBM50421371 O=C1CC2(CCCC2)CC(=O)N1CCCCNCC1COc2ccccc2C1
BDBM50421373 COc1cccc2OCC(CNCCCCN3C(=O)CC4(CCCC4)CC3=O)Cc12
BDBM50421374 CCCN(CCC)CC1(COc2cccc(OC)c2C1)N(CCC)CCC
BDBM50421375 CCCN1CCN(Cc2ccccc2)CC11COc2cccc(OC)c2C1
BDBM50421377 CCCN1CCN(CCCCN2C(=O)CC3(CCCC3)CC2=O)CC11COc2cccc(OC)c2C1
BDBM50421372 CCCN(CCC)CC1COc2cccc(OC)c2C1
BDBM50435344 COc1ccc2[nH]cc(CCN(CC=C)CC=C)c2c1
BDBM50019696 CNc1nc(nc2CCNCCc12)C(F)(F)c1ccccc1
BDBM50044849 COc1ccc(cc1)S(=O)(=O)Nc1c(C)cc(C)cc1C
BDBM255474 Cc1ccc2N=C(N3CCN(CC(C)(C)C(O)=O)CC3)c3cc(Cl)sc3Oc2c1 |t:5|
BDBM50058069 COc1ccccc1N1CCN(CCCCCC(=O)NCc2ccccc2-c2ccccc2Cl)CC1
BDBM50058214 COc1ccccc1N1CCN(CCCCC(=O)NCc2ccccc2-c2ccccc2Cl)CC1
BDBM50114872 COc1cc2C(CN(C)C3Cc4cc5OCOc5cc4-c(c1OC)c23)c1ccccc1
BDBM50114874 COc1cc2C(CN(C)C3Cc4cc5OCOc5cc4-c(c1OCC1CC1)c23)c1ccccc1
BDBM50114920 COc1cc2CCN(C)C3Cc4cc5OCOc5cc4-c(c1OC)c23
BDBM50140053 Fc1ccc2[nH]cc(CCN(CC=C)CC=C)c2c1
BDBM50140054 Clc1ccc2[nH]cc(CCN(CC=C)CC=C)c2c1
BDBM50140055 Brc1ccc2[nH]cc(CCN(CC=C)CC=C)c2c1
BDBM50140056 Cc1ccc2[nH]cc(CCN(CC=C)CC=C)c2c1
BDBM50140058 C=CCN(CCc1c[nH]c2ccccc12)CC=C
BDBM50114873 CCCOc1c(OC)cc2C(CN(C)C3Cc4cc5OCOc5cc4-c1c23)c1ccccc1
BDBM50148831 NC1=NC2(CCCCC2)NC(Nc2cccc(Br)c2)=N1 |c:20,t:1|
BDBM50148832 CCNC(=O)c1cccc(NC2=NC(N)=NC3(CCCCC3)N2)c1 |c:14,t:11|
BDBM50148833 CCOC(=O)c1cccc(NC2=NC(N)=NC3(CCCCC3)N2)c1 |c:14,t:11|
BDBM50147217 Cl.COc1ccccc1N1CCN(CCCCC(=O)n2c3ccccc3c3ccccc23)CC1
BDBM50147322 Cl.COc1ccccc1N1CCN(CCCCCC(=O)n2c3ccccc3c3ccccc23)CC1
BDBM50148830 CCOC(=O)c1cccc(NC2=NC(=NC3(CCCCC3)N2)N(C)C)c1 |c:13,t:11|
BDBM81993 CC(C)C[C@@H]1N2C(=O)[C@](NC(=O)[C@H]3CN(C)[C@@H]4Cc5c(Br)[nH]c6cccc(C4=C3)c56)(O[C@@]2(O)[C@@H]2CCCN2C1=O)C(C)C |r,c:28|
BDBM50204306 [H][C@@]12CCC[C@@]3([H])N(CCC)CC[C@@]([H])(c4cc5ccc(cc5nc4[C@@H]1CC)C(F)(F)F)[C@]23[H] |r|
BDBM50204312 [H][C@]12CCN(C)[C@]3([H])CCC[C@]([H])([C@@H](Cc4ccccc4)C(=O)C1)[C@@]23[H] |r|
BDBM50212607 CCCN(CCCCNC(=O)c1cc(=O)oc2c3CCCN4CCCc(cc12)c34)C1COc2cccc(OC)c2C1
BDBM50212622 CCCN(CCCCNc1ccc([N+]([O-])=O)c2nonc12)C1COc2cccc(OC)c2C1
BDBM50207400 CC(=O)c1ccc(OCc2ccc(Oc3cc(ccn3)-c3nn[nH]n3)cc2)c(C)c1O