Browse Molecules

Molecule ID SMILES Charge States Microspecies
mol161 O=c1n(CCCN2CCN(c3cccc(Cl)c3)CC2)nc2ccccn12 2 2
mol162 CN1CCCC(n2nc(Cc3ccc(Cl)cc3)c3ccccc3c2=O)CC1 2 2
mol163 CCC(=O)N(c1ccccc1)C1(COC)CCN(CCc2cccs2)CC1 2 2
mol164 OC(CNCC(O)C1CCc2cc(F)ccc2O1)C1CCc2cc(F)ccc2O1 2 2
mol165 Cc1nc2n(c(=O)c1CCN1CCC(c3noc4cc(F)ccc34)CC1)CCCC2 2 2
mol166 O=C(NCC1CCCCN1)c1cc(OCC(F)(F)F)ccc1OCC(F)(F)F 2 2
mol167 O=c1[nH]c2ccccc2n1CCCN1CCC(n2c(=O)[nH]c3cc(Cl)ccc32)CC1 3 4
mol168 CCc1nn(CCCN2CCN(c3cccc(Cl)c3)CC2)c(=O)n1CCOc1ccccc1 2 2
mol169 CN1CC(C(=O)N[C@]2(C)O[C@]3(O)C(C2=O)[C@@H](Cc2ccccc2)C(=O)N2CCC[C@H]23)C=C2c3cccc4[nH]cc(c34)C[C@H]21 2 2
mol170 C1CN1 2 2
mol171 CCN 2 2
mol172 CN1CC1 2 2
mol173 C1CNC1 2 2
mol174 CN(C)C 2 2
mol175 CCNC 2 2
mol176 NCCF 2 2
mol177 C1CCNC1 2 2
mol178 CCN(C)C 2 2
mol179 CCCCN 2 2
mol180 NCC(=O)O 3 3