Compound Name

SMILES String

Brc1ccc2[nH]c-3c(CC(=O)Nc4ccccc-34)c2c1

Brc1cnc(Nc2ccc(cc2)C(=O)N2CCC(CC2)N2CCCC2)nc1-c1cc2ccccc2s1

CN(C)C1CCN(CC1)C(=O)c1ccc(Nc2nccc(n2)-c2cc3ccccc3s2)cc1

CN(C)CCCNC(=O)c1ccc(Nc2nccc(n2)-c2cc3ccccc3s2)cc1

CN1CCC(CC1)NC(=O)c1ccc(Nc2nccc(n2)-c2cc3ccccc3s2)cc1

CN1CCN(CC1)C(=O)c1ccc(Nc2nccc(n2)-c2cc3ccccc3s2)cc1

CN1CCN(CCCNC(=O)c2ccc(Nc3nccc(n3)-c3cc4ccccc4s3)cc2)CC1

COc1ccc2cc(oc2c1)C(=O)c1ccc(cc1)C#N

CS(=O)(=O)CCCNC(=O)c1ccc(Nc2nccc(n2)-c2cc3ccccc3s2)cc1

Cc1ccc(s1)-c1ccnc(Nc2ccc(cc2)C(=O)N2CCC(CC2)N2CCCC2)n1

Cc1ccc(s1)-c1nc(Nc2ccc(cc2)C(=O)N2CCC(CC2)N2CCCC2)ncc1Cl

Cc1ccc(s1)-c1nc(Nc2ccc(cc2)C(=O)NCCCN2CCOCC2)ncc1Cl

Cc1cnc(Nc2ccc(cc2)C(=O)N2CCC(CC2)N2CCCC2)nc1-c1cc2ccccc2s1

Cc1cnc(Nc2ccc(cc2)C(=O)N2CCC(CC2)N2CCCC2)nc1-c1ccc(Cl)s1

Clc1ccc(cc1Cl)-c1ccnc(Nc2ccc(cc2)C(=O)N2CCC(CC2)N2CCCC2)n1

Clc1ccc(s1)-c1ccnc(Nc2ccc(cc2)C(=O)N2CCC(CC2)N2CCCC2)n1

Clc1ccc(s1)-c1nc(Nc2ccc(cc2)C(=O)N2CCC(CC2)N2CCCC2)ncc1Cl

Clc1ccc(s1)-c1nc(Nc2ccc(cc2)C(=O)NCCCN2CCOCC2)ncc1Cl

Clc1cnc(Nc2ccc(cc2)C(=O)N2CCC(CC2)N2CCCC2)nc1-c1cc2ccccc2s1

FC(F)(F)COCc1ccc(s1)-c1ccnc(Nc2ccc(cc2)C(=O)N2CCC(CC2)N2CCCC2)n1

Fc1cnc(Nc2ccc(cc2)C(=O)N2CCC(CC2)N2CCCC2)nc1-c1cc2ccccc2s1

NC1=NC(=O)\C(N1)=C1/CCNC(=O)c2[nH]c(Br)cc12 |t:1|

Nc1c(sc2nc(N)c(C#N)c(-c3ccccc3Cl)c12)C(=O)c1cccc(Cl)c1 |(27.03,-4.45,;26.56,-5.91,;27.47,-7.17,;26.56,-8.42,;25.08,-7.94,;23.75,-8.72,;22.42,-7.94,;21.08,-8.71,;22.42,-6.4,;21.08,-5.62,;19.75,-4.85,;23.75,-5.63,;23.74,-4.1,;25.07,-3.32,;25.07,-1.78,;23.73,-1.02,;22.4,-1.8,;22.41,-3.33,;21.08,-4.11,;25.08,-6.39,;29.01,-7.17,;29.78,-5.83,;29.78,-8.5,;29,-9.83,;29.77,-11.17,;31.32,-11.17,;32.08,-9.82,;33.62,-9.82,;31.31,-8.5,)|

O=C(N1CCC(CC1)N1CCCC1)c1ccc(Nc2nccc(n2)-c2cc3ccccc3o2)cc1

O=C(N1CCC(CC1)N1CCCC1)c1ccc(Nc2nccc(n2)-c2cc3ccccc3s2)cc1

O=C(N1CCC(CC1)N1CCCCC1)c1ccc(Nc2nccc(n2)-c2cc3ccccc3s2)cc1

O=C(NC1CC1)c1ccc(Nc2nccc(n2)-c2cc3ccccc3s2)cc1

O=C(NCCCN1CCOCC1)c1ccc(Nc2nccc(n2)-c2cc3ccccc3s2)cc1

O=C1Cc2c([nH+]c3ccn(Cc4ccccc4)cc23)-c2ccccc2N1

O=C1Cc2c([nH]c3ccccc23)-c2ccccc2N1

O=C1Cc2c([nH]c3ccncc23)-c2ccccc2N1

[O-][n+]1ccc2[nH]c-3c(CC(=O)Nc4ccccc-34)c2c1