Browse Molecules

Molecule ID SMILES Charge States Microspecies
mol18741 CCCC12CCC(=O)C=C1c1ccc(OCC(=O)O)cc1C2 2 2
mol18742 CCCC12CCC(=O)C=C1c1c(cc(OCC(=O)NCCN(C)C)c(Cl)c1Cl)C2 2 2
mol18743 CCC12CCC(=O)C=C1c1c(cc(OCC(=O)OCC(=O)O)c(Cl)c1Cl)C2 2 2
mol18744 Nc1ccc(C(=O)O)cn1 2 3
mol18745 NC1=NCC(C(=O)O)CC1 2 2
mol18746 O=C(O)c1cncnc1 2 3
mol18747 O=C(O)C1CN=CNC1 2 2
mol18748 Nc1ncc(C(=O)O)cn1 2 5
mol18749 NC1=NCC(C(=O)O)CN1 2 3
mol18750 CC(C)CNC(=O)[C@H]1C[C@@](F)(c2ccc(CN3CCCC3)c(F)c2)C1 2 2
mol18751 CCNC(=O)[C@H]1C[C@@](F)(c2ccc(CN3CCCC3)c(F)c2)C1 2 2
mol18752 CCN(C)C(=O)[C@H]1C[C@@H](c2ccc(CN3CCCC3)c(F)c2)C1 2 2
mol18753 CC(=O)N(C)C[C@H]1C[C@H](c2ccc(CN3CCCC3)c(Cl)c2)C1 2 2
mol18754 c1cnc(OC[C@H]2C[C@H](c3ccc(CN4CCCC4)cc3)C2)nc1 2 2
mol18755 c1cc([C@H]2C[C@@H](CN3CCOCC3)C2)ccc1CN1CCCC1 2 3
mol18756 CC/C=C1/NC(=O)C(c2ccccc2)=C1O 2 2
mol18757 O=C1C=C(O)CN1 2 2
mol18758 O=c1cc(O)c2ccc(Cl)cc2[nH]1 2 2
mol18759 CCc1oc2ccccc2c1C(O)c1cc(Br)c(O)c(Br)c1 2 2
mol18760 Cc1oc2ccccc2c1C(=O)c1cc(I)c(O)c(I)c1 2 2