ICL-SIRT078
HIT212709909
sdf文件结构编辑类似物检索
HIT ID: HIT212709909
Cas No: 1060430-64-9
分子式: C28H26N4O2S
分子量: 482.6
常用名: ICL-SIRT078
氢键受体数 (HBA): 5
氢键供体数 (HBD): 1
LogP: 4.481609
IUPAC: 4-[(2-methoxynaphthalen-1-yl)methyl]-11-{[(pyridin-3-yl)methyl]amino}-8-thia-4,6-diazatricyclo[7.4.0.0^{2,7}]trideca-1(9),2(7),5-trien-3-one
IUPAC: 4-[(2-methoxynaphthalen-1-yl)methyl]-11-{[(pyridin-3-yl)methyl]amino}-8-thia-4,6-diazatricyclo[7.4.0.0^{2,7}]trideca-1(9),2(7),5-trien-3-one
SMILES: COc1ccc2ccccc2c1Cn1cnc2sc3CC(CCc3c2c1=O)NCc1cccnc1
SMILES: COc1ccc2ccccc2c1Cn1cnc2sc3CC(CCc3c2c1=O)NCc1cccnc1
InChI key: UEJBOCXPGHSONP-UHFFFAOYSA-N
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