UCSF

ZINC66696856

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
August 30th, 2011 19 Yes

Popular Name: 6-chloro-2-[(4-ethylpiperazin-1-yl)methyl]imidazo[1,2-a]pyridine 6-chloro-2-[(4-ethylpiperazin-1-…

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) 2.24 7.76 -34.08 1 4 1 25 279.795 3 ↓
Hi High (pH 8-9.5) 2.24 5.5 -6.36 0 4 0 24 278.787 3 ↓
Mid Mid (pH 6-8) 2.24 7.92 -79.81 2 4 2 26 280.803 3 ↓

Activity (Go SEA)

Rings

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

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