UCSF

ZINC71514800

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
December 10th, 2011 25 Yes

Popular Name: 2-benzhydrylsulfanyl-6-methyl-3H-thieno[2,3-d]pyrimidin-4-one 2-benzhydrylsulfanyl-6-methyl-3H…

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) 5.62 10.79 -15.89 1 3 0 46 364.495 4 ↓
Mid Mid (pH 6-8) 6.08 9.32 -49.69 0 3 -1 49 363.487 4 ↓

Activity (Go SEA)

Rings

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

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