Browse Molecules

Molecule ID SMILES Charge States Microspecies
mol5521 O=c1[nH]c(=O)c2ncn([C@@H]3O[C@H](CO)[C@@H](O)[C@H]3O)c2[nH]1 5 13
mol5522 C=CC1=C(C)/C(=C/C2=N/C(=C\c3[nH]c(/C=C4\NC(=O)C(C)=C4C=C)c(C)c3CCC(=O)O)C(CCC(=O)O)=C2C)NC1=O 0 0
mol5523 C=Cc1c(C)c2cc3nc(c(CC(=O)O)c4nc(cc5[nH]c(cc1[nH]2)c(C)c5CC)C(C)=C4C(=O)O)[C@@H](CCC(=O)O)[C@@H]3C 0 0
mol5524 COC(=O)CCC1=C(C)c2cc3[nH]c(cc3C)cc3[nH]c(cc4nc(cc1n2)C(CCC(=O)OC)=C4C)c(CCC(=O)OC)c3C 0 0
mol5525 CC1=C(CCC(=O)O)c2cc3nc(cc4[nH]c(cc5[nH]c(cc1n2)c(CCC(=O)O)c5C)c(CCC(=O)O)c4C)C(CCC(=O)O)=C3C 6 18
mol5526 CCC1=C(C)C(=O)NC1=Cc1[nH]c(C=C2N=C(CC3NC(=O)C(CC)=C3C)C(C)=C2CCC(=O)O)c(CCC(=O)O)c1C 0 0
mol5527 C=Cc1c(C)c2cc3nc(c(C)c4nc(cc5[nH]c(cc1[nH]2)c(C)c5CC)C(C)=C4)[C@@H](CCC(=O)O)[C@@H]3C 3 5
mol5528 CCc1c(C)c2cc3[nH]c(cc4nc(c(C)c5nc(cc1[nH]2)C(C)=C5)C(CCC(=O)O)=C4C)c(C)c3CC 3 6
mol5529 CCC1=C(C)c2cc3[nH]c(cc4nc(cc5cc(C)c(cc1n2)[nH]5)[C@@H](CCC(=O)O)[C@@H]4C)c(C)c3CC 3 5
mol5530 CCC1=C(C)c2cc3nc(cc4cc(C)c(cc5[nH]c(cc1n2)c(C)c5CC)[nH]4)C(CCC(=O)O)=C3C 3 6
mol5531 C=CC1=C(C)C2=NC1=CC1=NC(=C(CC)/C1=C/O)C=C1N=C(C(CC(=O)O)=C3NC(=C2)C(C)C3CCC(=O)O)C(C(=O)O)=C1C 0 0
mol5532 CCC1=C(C)c2cc3nc(cc4[nH]c(cc5[nH]c(cc1n2)c(C)c5CC)c(C)c4C(=O)O)C(CCC(=O)O)=C3C 3 4
mol5533 CC[C@H]1[C@H](Cc2[nH]c(/C=C3\N=C(C[C@@H]4NC(=O)[C@H](CC)[C@H]4C)C(C)=C3CCC(=O)O)c(CCC(=O)O)c2C)NC(=O)[C@@H]1C 0 0
mol5534 C=CC1=C(C)C(CC2=N/C(=C/c3[nH]c(CC4NC(=O)C(C)=C4CC)c(C)c3CCC(=O)O)C(CCC(=O)O)=C2C)NC1=O 0 0
mol5535 CCC1=C(C)C(CC2=N/C(=C\c3[nH]c(CC4NC(=O)C(C)=C4CC)c(C)c3CCC(=O)O)C(CCC(=O)O)=C2C)NC1=O 0 0
mol5536 N[C@H]1C(O)O[C@H](CO)[C@@H](O)[C@@H]1O 2 2
mol5537 CNC[C@H](O)[C@@H](O)[C@H](O)[C@H](O)CO 2 2
mol5538 CN(CC(=O)O)C(=N)NP(=O)(O)O 5 7
mol5539 CC(C)=O 0 0
mol5540 CC(=O)c1ccccc1 0 0