UCSF

ZINC41585240

Draw Identity 99% 90% 80% 70%

Substance Information

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

Popular Name: (2Z)-7-[[4-(3-chlorophenyl)piperazin-1-yl]methyl]-2-[(4-fluorophenyl)methylene]-6-hydroxy-4-methyl-b (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) 5.71 10.77 -9.38 1 5 0 57 478.951 4 ↓
Mid Mid (pH 6-8) 5.71 11.36 -41.62 0 5 -1 60 477.943 4 ↓
Mid Mid (pH 6-8) 5.71 13.58 -31.16 1 5 0 61 478.951 4 ↓
Mid Mid (pH 6-8) 5.71 13.02 -51.62 2 5 1 58 479.959 4 ↓

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Rings

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

No pre-computed analogs available. Try a structural similarity search.