UCSF

ZINC37328685

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
November 24th, 2009 21 Yes

Popular Name: 2-[(3-acetylphenoxy)methyl]-3H-thieno[3,2-d]pyrimidin-4-one 2-[(3-acetylphenoxy)methyl]-3H-t…

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) 2.38 5.71 -21.28 1 5 0 72 300.339 4 ↓
Mid Mid (pH 6-8) 2.83 3.34 -60.22 0 5 -1 75 299.331 4 ↓

Activity (Go SEA)

Rings

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

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