UCSF

ZINC22680938

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
December 19th, 2008 30 No

Popular Name: 3-(4-fluorophenyl)-N-[(2S)-2-(4-methyl-1-piperidyl)-2-(2-thienyl)ethyl]-2-thioxo-1H-imidazole-4-carb 3-(4-fluorophenyl)-N-[(2S)-2-(4-…

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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) 3.51 12.95 -46.86 3 5 1 54 445.609 6 ↓
Mid Mid (pH 6-8) 3.51 10.7 -15.21 2 5 0 53 444.601 6 ↓

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

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