UCSF

ZINC70090935

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
November 3rd, 2011 21 Yes

Popular Name: 3-[5-(3-methyl-2-thienyl)-4-oxo-3H-thieno[2,3-d]pyrimidin-2-yl]propanoic 3-[5-(3-methyl-2-thienyl)-4-oxo-…

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) 2.43 7.59 -46.72 1 5 -1 86 319.387 4 ↓
Lo Low (pH 4.5-6) 2.43 5.61 -14.23 2 5 0 83 320.395 4 ↓

Activity (Go SEA)

Rings

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

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