UCSF

ZINC41585265

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Substance Information

In ZINC since Heavy atoms Benign functionality
April 21st, 2010 35 No

Popular Name: (2Z)-7-[[4-(3-chlorophenyl)piperazin-1-yl]methyl]-2-[(4-ethylphenyl)methylene]-6-hydroxy-4-methyl-be (2Z)-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) 6.46 12.15 -9.24 1 5 0 57 489.015 5 ↓
Mid Mid (pH 6-8) 6.46 14.96 -30.73 1 5 0 61 489.015 5 ↓
Mid Mid (pH 6-8) 6.46 14.39 -50.19 2 5 1 58 490.023 5 ↓
Mid Mid (pH 6-8) 6.46 12.73 -42.89 0 5 -1 60 488.007 5 ↓

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