L-697639
HIT212713022
sdf文件结构编辑类似物检索
HIT ID: HIT212713022
Cas No: 135525-77-8
分子式: C18H21N3O2
分子量: 311.385
常用名: L-697639
氢键受体数 (HBA): 3
氢键供体数 (HBD): 2
LogP: 2.6265416
IUPAC: 3-{[(4,7-dimethyl-1,3-benzoxazol-2-yl)methyl]amino}-5-ethyl-6-methyl-1,2-dihydropyridin-2-one
IUPAC: 3-{[(4,7-dimethyl-1,3-benzoxazol-2-yl)methyl]amino}-5-ethyl-6-methyl-1,2-dihydropyridin-2-one
SMILES: CCc1cc(NCc2nc3c(C)ccc(C)c3o2)c(=O)[nH]c1C
SMILES: CCc1cc(NCc2nc3c(C)ccc(C)c3o2)c(=O)[nH]c1C
InChI key: VDZJXIOFISBBLT-UHFFFAOYSA-N
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