Name: ERK1/2 inhibitor 8
Rating: 5 (10 reviews)

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sdf 文件

结构编辑

类似物检索

HIT ID:HIT214436108
Cas No:2648368-43-6
常用名:ERK1/2 inhibitor 8
IUPAC:5'-[(3-chlorophenyl)methyl]-2'-{5-methyl-2-[(1-methyl-1H-pyrazol-5-yl)amino]pyrimidin-4-yl}-4',5'-dihydrospiro[oxetane-3,6'-pyrrolo[3,4-d][1,3]thiazol]-4'-one
IUPAC:5'-[(3-chlorophenyl)methyl]-2'-{5-methyl-2-[(1-methyl-1H-pyrazol-5-yl)amino]pyrimidin-4-yl}-4',5'-dihydrospiro[oxetane-3,6'-pyrrolo[3,4-d][1,3]thiazol]-4'-one
InChI key:AYSQKFWYWKVYSQ-UHFFFAOYSA-N

分子式:C23H20ClN7O2S
分子量:493.97
氢键供体数 (HBD):
氢键受体数 (HBA):
LogP:
SMILES:Cc1cnc(Nc2ccnn2C)nc1-c1nc2C(=O)N(Cc3cccc(Cl)c3)C3(COC3)c2s1
SMILES:Cc1cnc(Nc2ccnn2C)nc1-c1nc2C(=O)N(Cc3cccc(Cl)c3)C3(COC3)c2s1

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