UCSF

ZINC41514669

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Substance Information

In ZINC since Heavy atoms Benign functionality
April 20th, 2010 30 No

Popular Name: (2Z)-7-[[benzyl(methyl)amino]methyl]-2-[(2,6-dichlorophenyl)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) 5.59 11.61 -45.18 2 4 1 55 441.334 5 ↓
Hi High (pH 8-9.5) 5.59 10.06 -43.06 0 4 -1 57 439.318 5 ↓
Mid Mid (pH 6-8) 5.59 9.29 -8.83 1 4 0 54 440.326 5 ↓
Mid Mid (pH 6-8) 5.59 12.38 -30.06 1 4 0 58 440.326 5 ↓

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