UCSF

ZINC33139796

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
May 18th, 2009 35 Yes

Popular Name: N-[(3-methoxyphenyl)methyl]-4-[2-[2-(4-pyridyl)imidazo[4,5-b]pyridin-3-yl]ethyl]piperazine-1-carboxa N-[(3-methoxyphenyl)methyl]-4-[2…

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) 2.98 8.34 -17.51 1 9 0 88 471.565 7 ↓
Mid Mid (pH 6-8) 2.98 10.61 -60.58 2 9 1 90 472.573 7 ↓
Lo Low (pH 4.5-6) 2.98 11.04 -121.06 3 9 2 91 473.581 7 ↓

Activity (Go SEA)

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