UCSF

ZINC67934605

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
September 17th, 2011 28 Yes

Popular Name: 5-[2-(1-piperidyl)acetyl]-1-(2-pyridylmethyl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carboxylic 5-[2-(1-piperidyl)acetyl]-1-(2-p…

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) 0.89 9.45 -66.91 1 8 0 96 383.452 5 ↓
Hi High (pH 8-9.5) 0.89 7.29 -61.9 0 8 -1 94 382.444 5 ↓

Activity (Go SEA)

Rings

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

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