UCSF

ZINC36868923

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
November 16th, 2009 19 No

Popular Name: 2-[[4-(chloromethyl)-3,5-dimethyl-pyrazol-1-yl]methyl]imidazo[1,2-a]pyridine 2-[[4-(chloromethyl)-3,5-dimethy…

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) 2.53 8.87 -12.99 0 4 0 35 274.755 3 ↓
Lo Low (pH 4.5-6) 2.53 9.32 -32.4 1 4 1 36 275.763 3 ↓

Activity (Go SEA)

Rings

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

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