9-ING-41
HIT212659520
sdf文件结构编辑类似物检索
HIT ID: HIT212659520
Cas No: 1034895-42-5
分子式: C22H13FN2O5
分子量: 404.353
常用名: 9-ING-41
氢键受体数 (HBA): 4.0
氢键供体数 (HBD): 1.0
LogP: 4.31
IUPAC: 3-(5-fluoro-1-benzofuran-3-yl)-4-{5-methyl-2H,5H-[1,3]dioxolo[4,5-f]indol-7-yl}-2,5-dihydro-1H-pyrrole-2,5-dione
IUPAC: 3-(5-fluoro-1-benzofuran-3-yl)-4-{5-methyl-2H,5H-[1,3]dioxolo[4,5-f]indol-7-yl}-2,5-dihydro-1H-pyrrole-2,5-dione
SMILES: Cn1cc(C2=C(C(=O)NC2=O)c2coc3ccc(F)cc23)c2cc3OCOc3cc12 |t:4|
SMILES: Cn1cc(C2=C(C(=O)NC2=O)c2coc3ccc(F)cc23)c2cc3OCOc3cc12 |t:4|
InChI key: FARXPFGGGGLENU-UHFFFAOYSA-N
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