UCSF

ZINC49520125

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
October 1st, 2010 20 Yes

Popular Name: (2R)-N-[2-(benzimidazol-1-yl)ethyl]-1,4-dioxane-2-carboxamide (2R)-N-[2-(benzimidazol-1-yl)eth…

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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) 0.23 5.27 -19.34 1 6 0 65 275.308 4 ↓
Mid Mid (pH 6-8) 0.23 5.75 -44.8 2 6 1 67 276.316 4 ↓

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

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