UCSF

ZINC37115737

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
November 20th, 2009 18 Yes

Popular Name: (3R)-1-thieno[3,2-d]pyrimidin-4-ylpiperidine-3-carboxylic (3R)-1-thieno[3,2-d]pyrimidin-4-…

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) 1.54 7.59 -45.87 0 5 -1 69 262.314 2 ↓
Lo Low (pH 4.5-6) 1.54 8.04 -53.3 1 5 0 70 263.322 2 ↓

Activity (Go SEA)

Rings

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