UCSF

ZINC38740657

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
January 29th, 2010 36 Yes

Popular Name: N-[2-(4,5-dimethyl-6-oxo-1H-pyrimidin-2-yl)-5-(2-thienyl)pyrazol-3-yl]-1-ethyl-7-methyl-4-oxo-1,8-na N-[2-(4,5-dimethyl-6-oxo-1H-pyri…

Find On: PubMed — Wikipedia — Google

Download: MOL2 SDF SMILES Flexibase

Annotations

Vendors

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) 2.97 12.25 -68.65 1 10 -1 131 500.564 5 ↓
Mid Mid (pH 6-8) 2.52 13.71 -27.25 2 10 0 128 501.572 5 ↓

Activity (Go SEA)

Rings

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