UCSF

ZINC64976668

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
July 1st, 2011 26 Yes

Popular Name: 5-bromo-6-[4-(2-pyridyl)piperazin-1-yl]sulfonyl-benzimidazol-2-one 5-bromo-6-[4-(2-pyridyl)piperazi…

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Download: MOL2 SDF SMILES Flexibase

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) 1.79 3.22 -13.78 2 8 0 102 438.307 3 ↓
Mid Mid (pH 6-8) 1.79 3.53 -41.55 3 8 1 103 439.315 3 ↓

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Rings

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

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