UCSF

ZINC41514663

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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-chloro-6-fluoro-phenyl)methylene]-6-hydroxy-benzofuran-3- (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) 5.08 12.01 -45.09 2 4 1 55 424.879 5 ↓
Hi High (pH 8-9.5) 5.08 10.21 -42.52 0 4 -1 57 422.863 5 ↓
Mid Mid (pH 6-8) 5.08 9.65 -10.31 1 4 0 54 423.871 5 ↓
Mid Mid (pH 6-8) 5.08 12.57 -28.99 1 4 0 58 423.871 5 ↓

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Analogs ( Draw Identity 99% 90% 80% 70% )