UCSF

ZINC39689873

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
March 3rd, 2010 34 Yes

Popular Name: (1S)-3-(4-chloro-1,3-dimethyl-pyrazolo[3,4-b]pyridine-5-carbonyl)-N-[[(3R)-1-methylpyrrolidin-3-yl]m (1S)-3-(4-chloro-1,3-dimethyl-py…

Find On: PubMed — Wikipedia — Google

Download: MOL2 SDF SMILES Flexibase

Annotations

Vendors

    None

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) 0.35 7.23 -112.6 4 9 2 101 490.052 4 ↓

Activity (Go SEA)

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