4-(4-methoxyphenyl)-2-(methylsulfanyl)-6-{2-[(3,4,5-trimethoxyphenyl)methylidene]hydrazin-1-yl}pyrimidine-5-carbonitrile, PI3K/AKT-IN-1, PI3K/AKT 抑制剂 1
HIT218673838
sdf文件结构编辑类似物检索
HIT ID: HIT218673838
Cas No: 3033069-84-7
分子式: C23H23N5O4S
分子量: 465.53
常用名: 4-(4-methoxyphenyl)-2-(methylsulfanyl)-6-{2-[(3,4,5-trimethoxyphenyl)methylidene]hydrazin-1-yl}pyrimidine-5-carbonitrile, PI3K/AKT-IN-1, PI3K/AKT 抑制剂 1
氢键受体数 (HBA):
氢键供体数 (HBD):
LogP:
IUPAC: 4-(4-methoxyphenyl)-2-(methylsulfanyl)-6-{2-[(3,4,5-trimethoxyphenyl)methylidene]hydrazin-1-yl}pyrimidine-5-carbonitrile
SMILES: COc1ccc(cc1)-c1nc(SC)nc(NN=Cc2cc(OC)c(OC)c(OC)c2)c1C#N
InChI key: WGUUTVSZGSTNKU-UHFFFAOYSA-N
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