Name: 1E7-03
Rating: 5 (10 reviews)

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sdf 文件

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HIT ID:HIT213131979
Cas No:1565845-92-2
常用名:1E7-03
IUPAC:1-[(ethylcarbamoyl)amino]-1-oxopropan-2-yl 3-[(3,4-dimethoxyphenyl)methylidene]-1H,2H,3H-cyclopenta[b]quinoline-9-carboxylate
IUPAC:1-[(ethylcarbamoyl)amino]-1-oxopropan-2-yl 3-[(3,4-dimethoxyphenyl)methylidene]-1H,2H,3H-cyclopenta[b]quinoline-9-carboxylate
InChI key:PHJQCMBFMOQNFF-UHFFFAOYSA-N

分子式:C28H29N3O6
分子量:503.555
氢键供体数 (HBD):2
氢键受体数 (HBA):6
LogP:4.494
SMILES:CCNC(=O)NC(=O)C(C)OC(=O)c1c2CCC(=Cc3ccc(OC)c(OC)c3)c2nc2ccccc12 |w:18.18|
SMILES:CCNC(=O)NC(=O)C(C)OC(=O)c1c2CCC(=Cc3ccc(OC)c(OC)c3)c2nc2ccccc12 |w:18.18|

1E7-03 is an inhibitor of HIV-1 transcription, by targeting host Protein Phosphatase-1 (PP1).

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