UCSF

ZINC62977219

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Substance Information

In ZINC since Heavy atoms Benign functionality
May 21st, 2011 37 No

Popular Name: (2E)-7-[[4-(3-chlorophenyl)piperazin-1-yl]methyl]-2-[[4-(diethylamino)phenyl]methylene]-6-hydroxy-be (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) 6.03 12.31 -44.6 2 6 0 61 519.065 7 ↓
Hi High (pH 8-9.5) 6.03 12.78 -44.72 0 6 -1 63 517.049 7 ↓
Mid Mid (pH 6-8) 6.03 12.91 -60.49 1 6 0 64 518.057 7 ↓
Mid Mid (pH 6-8) 6.03 14.55 -83.92 3 6 0 63 520.073 7 ↓
Mid Mid (pH 6-8) 6.03 12.18 -10.42 1 6 0 60 518.057 7 ↓

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