UCSF

ZINC41514512

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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-chlorophenyl)methylene]-6-hydroxy-4-methyl-benzofuran-3-o (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) 5.34 12.17 -51.09 2 4 1 55 420.916 5 ↓
Hi High (pH 8-9.5) 5.34 10.61 -42.37 0 4 -1 57 418.9 5 ↓
Mid Mid (pH 6-8) 5.34 9.85 -8.37 1 4 0 54 419.908 5 ↓
Mid Mid (pH 6-8) 5.34 12.94 -33.21 1 4 0 58 419.908 5 ↓

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