UCSF

ZINC42137124

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
April 25th, 2010 21 Yes

Popular Name: 2-(4,6-diaminopyrimidin-2-yl)sulfanylimidazo[1,2-a]pyridine-3-carboxylic 2-(4,6-diaminopyrimidin-2-yl)sul…

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) 1.36 3.59 -64.77 4 8 -1 135 301.311 3 ↓
Lo Low (pH 4.5-6) 1.36 4.18 -45.57 5 8 0 137 302.319 3 ↓

Activity (Go SEA)

Rings

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

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