UCSF

ZINC55503116

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
December 15th, 2010 24 Yes

Popular Name: N-isopropyl-2-(5-methyl-4-oxo-6-phenyl-3H-thieno[2,3-d]pyrimidin-2-yl)acetamide N-isopropyl-2-(5-methyl-4-oxo-6-…

Find On: PubMed — Wikipedia — Google

Download: MOL2 SDF SMILES Flexibase

Annotations

None

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) 3.10 7.51 -18.95 2 5 0 75 341.436 4 ↓
Hi High (pH 8-9.5) 3.56 4.56 -57.47 1 5 -1 78 340.428 4 ↓

Activity (Go SEA)

Rings

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

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