UCSF

ZINC69947877

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
November 1st, 2011 16 Yes

Popular Name: N-(6-methyl-2-pyridyl)-1H-imidazole-4-sulfonamide N-(6-methyl-2-pyridyl)-1H-imidaz…

Find On: PubMed — Wikipedia — Google

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) 0.31 2.71 -42.03 3 6 1 92 239.28 2 ↓
Mid Mid (pH 6-8) 0.13 2.26 -50.19 2 6 0 91 238.272 3 ↓
Mid Mid (pH 6-8) 0.31 2.19 -22.8 2 6 0 91 238.272 2 ↓

Activity (Go SEA)

Rings

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

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