Browse Molecules

Molecule ID SMILES Charge States Microspecies
mol27121 O=C(CCCCC(=O)CC(=O)c1ccccc1)CC(=O)c1ccccc1 0 0
mol27122 O=C(Cc1cc[n+](Cc2ccccc2)cc1)c1ccc(C(F)(F)F)cc1 0 0
mol27123 C=CCCC(=O)CC(=O)CCCCCCCCC(=O)CC(=O)CCC=C 0 0
mol27124 N#CC(C#N)(Cc1ccccc1)C(CC(=O)c1ccccc1)c1ccccc1 0 0
mol27125 O=C(CCCCCC(=O)CC(=O)c1ccccc1)CC(=O)c1ccccc1 0 0
mol27126 O=C(Cc1cc[n+](Cc2ccc(Br)cc2)cc1)c1ccccc1 0 0
mol27127 O=C(CC(=O)c1ccc(C(=O)CC(=O)c2ccccc2)cc1)c1ccccc1 0 0
mol27128 O=C(Cc1c(F)c(F)c(F)c(F)c1F)c1c(F)c(F)c(F)c(F)c1F 0 0
mol27129 O=C(Cc1cc[n+](Cc2cc([N+](=O)[O-])cc([N+](=O)[O-])c2)cc1)c1ccccc1 0 0
mol27130 COCC(=O)C(C(C)=O)C(c1ccc(OC)cc1)C(C(C)=O)C(=O)COC 0 0
mol27131 O=C(CCCCCCC(=O)CC(=O)c1ccccc1)CC(=O)c1ccccc1 0 0
mol27132 O=C(C[P+](c1ccccc1)(c1ccccc1)c1ccccc1)c1ccccc1 0 0
mol27133 COCC(=O)C(C(C)=O)C(c1ccc(N(C)C)cc1)C(C(C)=O)C(=O)COC 0 0
mol27134 O=C(CCCCCCCC(=O)CC(=O)c1ccccc1)CC(=O)c1ccccc1 0 0
mol27135 O=C(CCCCCCCCC(=O)CC(=O)c1ccccc1)CC(=O)c1ccccc1 0 0
mol27136 O=C(Cc1c(F)c(F)c(C(F)(F)F)c(F)c1F)c1c(F)c(F)c(F)c(F)c1F 0 0
mol27137 NC=O 0 0
mol27138 CNC=O 3 3
mol27139 O=C1CCN1 0 0
mol27140 NC(=O)CO 0 0