UCSF

ZINC41514660

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Substance Information

In ZINC since Heavy atoms Benign functionality
April 20th, 2010 29 No

Popular Name: (2Z)-7-[[benzyl(methyl)amino]methyl]-2-[(4-chlorophenyl)methylene]-6-hydroxy-benzofuran-3-one (2Z)-7-[[benzyl(methyl)amino]met…

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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) 5.01 11.71 -47.31 2 4 1 55 406.889 5 ↓
Hi High (pH 8-9.5) 5.01 10.14 -41.58 0 4 -1 57 404.873 5 ↓
Mid Mid (pH 6-8) 5.01 9.37 -7.96 1 4 0 54 405.881 5 ↓
Mid Mid (pH 6-8) 5.01 12.48 -30.03 1 4 0 58 405.881 5 ↓

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