UCSF

ZINC41514672

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Substance Information

In ZINC since Heavy atoms Benign functionality
April 20th, 2010 31 No

Popular Name: (2Z)-7-[[benzyl(methyl)amino]methyl]-2-[(4-ethoxyphenyl)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) 4.76 11.75 -46.8 2 5 1 64 416.497 7 ↓
Hi High (pH 8-9.5) 4.76 9.95 -42.67 0 5 -1 66 414.481 7 ↓
Mid Mid (pH 6-8) 4.76 9.39 -9.89 1 5 0 63 415.489 7 ↓
Mid Mid (pH 6-8) 4.76 12.31 -29.19 1 5 0 67 415.489 7 ↓

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