UCSF

ZINC41585605

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Substance Information

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

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

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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) 5.60 10.91 -10.45 1 5 0 57 458.533 5 ↓
Mid Mid (pH 6-8) 5.60 11.49 -40.95 0 5 -1 60 457.525 5 ↓
Mid Mid (pH 6-8) 5.60 13.16 -51.11 2 5 1 58 459.541 5 ↓
Mid Mid (pH 6-8) 5.60 13.72 -33.75 1 5 0 61 458.533 5 ↓

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