UCSF

ZINC62801116

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
May 13th, 2011 20 Yes

Popular Name: 5-(imidazo[1,2-a]pyridin-2-ylmethylsulfanyl)-4-isopropyl-1,2,4-triazol-3-amine 5-(imidazo[1,2-a]pyridin-2-ylmet…

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) 2.12 9.81 -17.06 2 6 0 74 288.38 4 ↓
Lo Low (pH 4.5-6) 2.12 10.26 -35.23 3 6 1 75 289.388 4 ↓

Activity (Go SEA)

Rings

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

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