UCSF

ZINC42136847

Draw Identity 99% 90% 80% 70%

Substance Information

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

Popular Name: 2-[[(2S)-1-ethylpyrrolidin-2-yl]methylamino]imidazo[1,2-a]pyridine-3-carboxylic 2-[[(2S)-1-ethylpyrrolidin-2-yl]…

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) 1.89 8.18 -56.49 2 6 0 74 288.351 5 ↓
Hi High (pH 8-9.5) 1.89 6.04 -61.9 1 6 -1 73 287.343 5 ↓
Mid Mid (pH 6-8) 1.89 8.62 -73.24 3 6 1 75 289.359 5 ↓

Activity (Go SEA)

Rings

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

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