HIT ID: HIT214435431
Cas No: 2642394-38-3
分子式: C17H13N3O4
分子量: 323.308
常用名: Mtb ATP synthase-IN-1
氢键受体数 (HBA):
氢键供体数 (HBD):
LogP:
IUPAC: 3-[(2H-1,3-benzodioxol-5-yl)amino]-4-{[(pyridin-2-yl)methyl]amino}cyclobut-3-ene-1,2-dione
IUPAC: 3-[(2H-1,3-benzodioxol-5-yl)amino]-4-{[(pyridin-2-yl)methyl]amino}cyclobut-3-ene-1,2-dione
SMILES: O=c1c(NCc2ccccn2)c(Nc2ccc3OCOc3c2)c1=O
SMILES: O=c1c(NCc2ccccn2)c(Nc2ccc3OCOc3c2)c1=O
InChI key: ZEYYGLIHJGBVNS-UHFFFAOYSA-N