UCSF

ZINC41585384

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Substance Information

In ZINC since Heavy atoms Benign functionality
April 21st, 2010 36 No

Popular Name: (2E)-7-[[4-(2-fluorophenyl)piperazin-1-yl]methyl]-6-hydroxy-2-[(4-isopropylphenyl)methylene]-4-methy (2E)-7-[[4-(2-fluorophenyl)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) 6.52 14.72 -40.52 2 5 1 58 487.595 5 ↓
Mid Mid (pH 6-8) 6.52 13.07 -47.56 0 5 -1 60 485.579 5 ↓
Mid Mid (pH 6-8) 6.52 15.29 -29.27 1 5 0 61 486.587 5 ↓
Mid Mid (pH 6-8) 6.52 12.48 -9.31 1 5 0 57 486.587 5 ↓

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