HIT ID: HIT212717488
Cas No: 82144-26-1
分子式: C21H24N8O6
分子量: 484.473
常用名: NSC 152737
氢键受体数 (HBA): 13
氢键供体数 (HBD): 5
LogP: -0.40661478
IUPAC: (2S)-2-[(4-{[(2,4-diaminopteridin-6-yl)methyl](methyl)amino}-3-methoxyphenyl)formamido]pentanedioic acid
IUPAC: (2S)-2-[(4-{[(2,4-diaminopteridin-6-yl)methyl](methyl)amino}-3-methoxyphenyl)formamido]pentanedioic acid
SMILES: COc1cc(ccc1N(C)Cc1cnc2nc(N)nc(N)c2n1)C(=O)N[C@@H](CCC(O)=O)C(O)=O
SMILES: COc1cc(ccc1N(C)Cc1cnc2nc(N)nc(N)c2n1)C(=O)N[C@@H](CCC(O)=O)C(O)=O
InChI key: XEBAVCRVAZGBDT-LBPRGKRZSA-N
