BRD5648
HIT212671116
sdf文件结构编辑类似物检索
HIT ID: HIT212671116
Cas No: 2056261-42-6
分子式: C20H23N3O
分子量: 321.424
常用名: BRD5648
氢键受体数 (HBA): 4
氢键供体数 (HBD): 2
LogP: 2.692261
IUPAC: (4R)-4-ethyl-7,7-dimethyl-4-phenyl-1H,2H,4H,5H,6H,7H,8H-pyrazolo[3,4-b]quinolin-5-one
IUPAC: (4R)-4-ethyl-7,7-dimethyl-4-phenyl-1H,2H,4H,5H,6H,7H,8H-pyrazolo[3,4-b]quinolin-5-one
SMILES: CC[C@]1(C2=CNNC2=NC2=C1C(=O)CC(C)(C)C2)c1ccccc1 |c:8,10,t:3|
SMILES: CC[C@]1(C2=CNNC2=NC2=C1C(=O)CC(C)(C)C2)c1ccccc1 |c:8,10,t:3|
InChI key: NCKLQXXBRWCYMA-HXUWFJFHSA-N
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