UCSF

ZINC54710957

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
December 6th, 2010 18 Yes

Popular Name: (3R)-3-(4-aminothieno[2,3-d]pyrimidin-2-yl)sulfanylpyrrolidine-2,5-dione (3R)-3-(4-aminothieno[2,3-d]pyri…

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) 1.11 -1.07 -49.8 2 6 -1 104 279.326 2 ↓
Lo Low (pH 4.5-6) 0.92 1.45 -15.11 3 6 0 98 280.334 2 ↓

Activity (Go SEA)

Rings

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

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