UCSF

ZINC41514591

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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-ethylphenyl)methylene]-6-hydroxy-4-methyl-benzofuran-3-on (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) 5.62 13.6 -46.77 2 4 1 55 414.525 6 ↓
Hi High (pH 8-9.5) 5.62 11.8 -42.11 0 4 -1 57 412.509 6 ↓
Mid Mid (pH 6-8) 5.62 11.24 -8.52 1 4 0 54 413.517 6 ↓
Mid Mid (pH 6-8) 5.62 14.17 -28.67 1 4 0 58 413.517 6 ↓

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