UCSF

ZINC53336006

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
November 20th, 2010 16 Yes

Popular Name: 2-(2,5-dimethyl-3-thienyl)-4,5,6,7-tetrahydrothiazolo[5,4-c]pyridine 2-(2,5-dimethyl-3-thienyl)-4,5,6…

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) 2.90 6.52 -45.51 2 2 1 29 251.4 1 ↓
Mid Mid (pH 6-8) 2.90 4.58 -7.1 1 2 0 25 250.392 1 ↓

Activity (Go SEA)

Rings

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

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