Name: WDR5-IN-4
Rating: 5 (10 reviews)

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HIT ID:HIT212671705
Cas No:2407457-36-5
常用名:WDR5-IN-4
别名:WIN site inhibitor 1
IUPAC:N-[(3,4-dichlorophenyl)methyl]-3-(6-fluoro-2-methylpyridin-3-yl)-5-[(2-imino-3-methyl-2,3-dihydro-1H-imidazol-1-yl)methyl]benzamide
IUPAC:N-[(3,4-dichlorophenyl)methyl]-3-(6-fluoro-2-methylpyridin-3-yl)-5-[(2-imino-3-methyl-2,3-dihydro-1H-imidazol-1-yl)methyl]benzamide
InChI key:ZPVQIJIWGMKMQN-XLVZBRSZSA-N

分子式:C25H22Cl2FN5O
分子量:498.38
氢键供体数 (HBD):2
氢键受体数 (HBA):5
LogP:4.8579793
SMILES:Cc1nc(F)ccc1-c1cc(Cn2ccn(C)c2=N)cc(c1)C(=O)NCc1ccc(Cl)c(Cl)c1
SMILES:Cc1nc(F)ccc1-c1cc(Cn2ccn(C)c2=N)cc(c1)C(=O)NCc1ccc(Cl)c(Cl)c1

WIN site inhibitor 1 is a WIN site of chromatin-associated WD repeat-containing protein 5 (WDR5) inhibitor (Kd: 0.1 nM), with anti-cancer activity.

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