Browse Molecules

Molecule ID SMILES Charge States Microspecies
mol19501 OB(O)c1ccc(O)cc1 2 2
mol19502 OB(O)O 0 0
mol19503 O=c1[nH]c2ccccc2n1C1CCN(CCOc2ccccc2)CC1 2 2
mol19504 O=C1CCc2ccccc2N1CCCN1CCC(n2c(=O)[nH]c3ccccc32)CC1 2 2
mol19505 O=C(Cc1ccccc1)NC1CCN(CCCN2C(=O)COc3ccccc32)CC1 2 2
mol19506 O=C1CCc2ccccc2N1CCCN1CCC(c2ccc3[nH]ccc3c2)CC1 2 2
mol19507 O=C(O)C(=O)CC(=O)c1ccc(Cc2ccc(Cl)c(Cl)c2)cc1 3 3
mol19508 CCCCCCCCCC(=O)CC(=O)C(=O)O 2 2
mol19509 O=C(O)C(=O)CC(=O)c1ccc(-c2ccc(Br)cc2)cc1 3 3
mol19510 CO[C@H]1C(=O)N2C(C(=O)c3ccccc3)=C(C)CS(=O)(=O)[C@H]12 0 0
mol19511 CO[C@H]1C(=O)N2C(C(=O)c3ccccc3)=C(CSc3nnnn3C)C(Sc3nnnn3C)S(=O)(=O)[C@H]12 2 6
mol19512 CO[C@H]1C(=O)N2C(C(=O)C(C)(C)C)=C(CSc3nnnn3C)C(Sc3nnnn3C)S(=O)(=O)[C@H]12 0 0
mol19513 CO[C@H]1C(=O)N2C(C(=O)c3ccccc3)=C(C)C(Sc3nnnn3C)S(=O)(=O)[C@H]12 0 0
mol19514 CO[C@H]1C(=O)N2C(C(=O)C(C)(C)C)=C(CSc3nnnn3C)CS(=O)(=O)[C@H]12 0 0
mol19515 CO[C@H]1C(=O)N2C(C(=O)C(C)(C)C)=C(CSc3nnc(C)s3)CS(=O)(=O)[C@H]12 0 0
mol19516 CO[C@H]1C(=O)N2C(C(=O)C(C)(C)C)=C(C)C(Sc3nnc(C)s3)S(=O)(=O)[C@H]12 0 0
mol19517 CO[C@H]1C(=O)N2C(C(=O)C(C)(C)C)=C(C)C(Sc3nc(=O)c(=O)[nH]n3C)S(=O)(=O)[C@H]12 2 2
mol19518 CO[C@H]1C(=O)N2C(C(=O)C(C)(C)C)=C(CSc3nnc(C)s3)C(Sc3nnc(C)s3)S(=O)(=O)[C@H]12 0 0
mol19519 CO[C@H]1C(=O)N2C(C(=O)c3ccccc3)=C(CSc3nnnn3C)CS(=O)(=O)[C@H]12 0 0
mol19520 CO[C@H]1C(=O)N2C(C(=O)c3ccccc3)=C(C)C(Sc3nc(=O)c(=O)[nH]n3C)S(=O)(=O)[C@H]12 2 2