OT antagonist 3 analog
HIT212666387
sdf文件结构编辑类似物检索
HIT ID: HIT212666387
Cas No:
分子式: C20H18N6O2
分子量: 374.404
常用名: OT antagonist 3 analog
氢键受体数 (HBA): 5
氢键供体数 (HBD): 1
LogP: 1.9440545
IUPAC: 5-{3-[5-(2,3-dimethylphenoxy)pyrazin-2-yl]-5-methyl-4H-1,2,4-triazol-4-yl}-1,2-dihydropyridin-2-one
IUPAC: 5-{3-[5-(2,3-dimethylphenoxy)pyrazin-2-yl]-5-methyl-4H-1,2,4-triazol-4-yl}-1,2-dihydropyridin-2-one
SMILES: Cc1nnc(-c2cnc(Oc3cccc(C)c3C)cn2)n1-c1ccc(=O)[nH]c1
SMILES: Cc1nnc(-c2cnc(Oc3cccc(C)c3C)cn2)n1-c1ccc(=O)[nH]c1
InChI key: CMDRSQQWAVLUCP-UHFFFAOYSA-N
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