UCSF

ZINC41585259

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Substance Information

In ZINC since Heavy atoms Benign functionality
April 21st, 2010 33 No

Popular Name: (2Z)-2-benzylidene-7-[[4-(3-chlorophenyl)piperazin-1-yl]methyl]-6-hydroxy-4-methyl-benzofuran-3-one (2Z)-2-benzylidene-7-[[4-(3-chlo…

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Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 5.55 10.7 -9.51 1 5 0 57 460.961 4 ↓
Mid Mid (pH 6-8) 5.55 13.51 -30.92 1 5 0 61 460.961 4 ↓
Mid Mid (pH 6-8) 5.55 12.95 -50.26 2 5 1 58 461.969 4 ↓
Mid Mid (pH 6-8) 5.55 11.29 -43.01 0 5 -1 60 459.953 4 ↓

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