Browse Molecules

Molecule ID SMILES Charge States Microspecies
mol16681 COc1ccc(COc2cnn(CC(=O)c3ccc(CN(C)C)cc3C)c(=O)c2)nc1 2 3
mol16682 COc1ccc(-c2ccc(CCCNc3ccc(CN4CCCCC4)cc3)nn2)cc1 2 2
mol16683 COc1ccc(-c2ccc(CCCNc3ccc(CN4CCOCC4)cc3)nn2)cc1 2 2
mol16684 COc1ccc(-c2ccc(CCCNc3ccc(CN4CCCC(O)C4)cc3)nn2)cc1 2 2
mol16685 COc1ccc(-c2ccc(CCCNc3ccc(CN4CCC(O)CC4)cc3)nn2)cc1 2 2
mol16686 COc1ccc(-c2ccc(CCCNc3ccc(CN4CCC(NC(C)=O)CC4)cc3)nn2)cc1 2 3
mol16687 OC1CCN(Cc2ccc(NCCCc3ccc(Oc4ccccc4)nn3)cc2)CC1 2 3
mol16688 CC(=O)NC1CCN(Cc2ccc(NCCCc3ccc(Oc4ccccc4)nn3)cc2)CC1 2 2
mol16689 N#Cc1cc(NS(=O)(=O)c2ccccc2C(F)(F)F)ccc1C(F)(F)F 2 2
mol16690 N#Cc1ccc(NS(=O)(=O)c2ccccc2C(F)(F)F)cc1Cl 2 2
mol16691 N#Cc1cc(NS(=O)(=O)c2ccccc2C(F)(F)F)ccc1Cl 2 2
mol16692 O=S(=O)(Nc1cncc(Br)c1)c1ccccc1C(F)(F)F 2 2
mol16693 O=S(=O)(Nc1ccc(C(F)(F)F)nc1)c1ccccc1C(F)(F)F 2 2
mol16694 O=S(=O)(Nc1cncc(C(F)(F)F)c1)c1ccccc1C(F)(F)F 2 2
mol16695 CC1=CC(C)=[N+]2C1=C(c1ccc(N(C)C)cc1)c1c(C)cc(C)n1[B-]2(F)F 2 2
mol16696 CCN(CC)c1ccc(C2=C3C(C)=CC(C)=[N+]3[B-](F)(F)n3c(C)cc(C)c32)cc1 2 2
mol16697 CCN(CCCC(=O)OC)c1ccc(C2=C3C(C)=CC(C)=[N+]3[B-](F)(F)n3c(C)cc(C)c32)cc1 2 2
mol16698 CCN(CC)c1ccc(C2=C3C=CC(CCC(=O)OC)=[N+]3[B-](F)(F)n3c(CCC(=O)OC)ccc32)cc1 2 2
mol16699 COc1ccc(-c2cnc(N3Cc4c(nc5ccccc5c4O)[C@H]3c3ccc4c(c3)OCO4)nc2)cc1OC 2 2
mol16700 N#Cc1cc2[nH]cc(C(=O)O)c2cc1-c1ccc(C2(O)CCC2)cc1 2 2