UCSF

ZINC69173472

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
October 20th, 2011 27 Yes

Popular Name: (3R,6R)-N-butyl-1-[[1-(difluoromethyl)benzimidazol-2-yl]methyl]-6-methyl-piperidine-3-carboxamide (3R,6R)-N-butyl-1-[[1-(difluorom…

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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) 3.61 9.49 -44.46 2 5 1 51 379.475 7 ↓
Mid Mid (pH 6-8) 3.61 7.31 -14.96 1 5 0 50 378.467 7 ↓

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

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