UCSF

ZINC63720283

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
June 4th, 2011 13 Yes

Popular Name: (2S)-2H-imidazo[4,5-c]pyridine-2-sulfonic (2S)-2H-imidazo[4,5-c]pyridine-2…

Find On: PubMed — Wikipedia — Google

Download: MOL2 SDF SMILES Flexibase

Annotations

None

Vendors

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) -2.26 -3.31 -157.79 3 6 2 99 201.207 1 ↓
Hi High (pH 8-9.5) -2.26 -3.75 -65.88 2 6 1 98 200.199 1 ↓
Hi High (pH 8-9.5) -2.26 -4.75 -33.36 1 6 0 96 199.191 1 ↓

Activity (Go SEA)

Rings

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

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