UCSF

ZINC54917943

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
December 9th, 2010 18 Yes

Popular Name: [(3S)-1-(imidazo[1,2-a]pyrimidin-2-ylmethyl)-3-piperidyl]methanol [(3S)-1-(imidazo[1,2-a]pyrimidin…

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) 0.56 6.55 -43.99 2 5 1 55 247.322 3 ↓
Hi High (pH 8-9.5) 0.56 4.35 -17.07 1 5 0 54 246.314 3 ↓

Activity (Go SEA)

Rings

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

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