VU0071063
HIT106820266
sdf文件结构编辑类似物检索
HIT ID: HIT106820266
Cas No: 333415-38-6
分子式: C18H22N4O2
分子量: 326.4
常用名: VU0071063
氢键受体数 (HBA): 6
氢键供体数 (HBD): 0
LogP: 3.1703
IUPAC: 7-[(4-tert-butylphenyl)methyl]-1,3-dimethyl-2,3,6,7-tetrahydro-1H-purine-2,6-dione
IUPAC: 7-[(4-tert-butylphenyl)methyl]-1,3-dimethyl-2,3,6,7-tetrahydro-1H-purine-2,6-dione
SMILES: Cn1c2ncn(Cc3ccc(cc3)C(C)(C)C)c2c(=O)n(C)c1=O
SMILES: Cn1c2ncn(Cc3ccc(cc3)C(C)(C)C)c2c(=O)n(C)c1=O
InChI key: ZFZAIHKQJBMYLO-UHFFFAOYSA-N
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