UCSF

ZINC41585307

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Substance Information

In ZINC since Heavy atoms Benign functionality
April 21st, 2010 34 No

Popular Name: (2E)-7-[[4-(3-chlorophenyl)piperazin-1-yl]methyl]-2-[(4-ethylphenyl)methylene]-6-hydroxy-benzofuran- (2E)-7-[[4-(3-chlorophenyl)piper…

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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) 6.09 11.36 -9.56 1 5 0 57 474.988 5 ↓
Mid Mid (pH 6-8) 6.09 11.95 -42.27 0 5 -1 60 473.98 5 ↓
Mid Mid (pH 6-8) 6.09 13.61 -48.72 2 5 1 58 475.996 5 ↓
Mid Mid (pH 6-8) 6.09 14.16 -31.14 1 5 0 61 474.988 5 ↓

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