UCSF

ZINC69259012

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
October 21st, 2011 27 Yes

Popular Name: 1-butyl-N,N-dimethyl-2-[(2-methylthiazol-4-yl)methylsulfanyl]benzimidazole-5-sulfonamide 1-butyl-N,N-dimethyl-2-[(2-methy…

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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) 3.62 8.14 -15.31 0 6 0 68 424.617 8 ↓
Lo Low (pH 4.5-6) 3.62 8.6 -34.84 1 6 1 69 425.625 8 ↓

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

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