UCSF

ZINC58344284

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
February 5th, 2011 23 Yes

Popular Name: N-[(1R)-1-methyl-2-(2-oxopyrrolidin-1-yl)ethyl]-2-oxo-6-(trifluoromethyl)-1H-pyridine-3-carboxamide N-[(1R)-1-methyl-2-(2-oxopyrroli…

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) 1.01 3.49 -55.29 1 6 -1 85 330.286 5 ↓
Lo Low (pH 4.5-6) 0.56 4.96 -14.84 2 6 0 82 331.294 5 ↓

Activity (Go SEA)

Rings

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

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