UCSF

ZINC69517191

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
October 26th, 2011 23 Yes

Popular Name: 2-[(2R)-2-(1,3-dioxolan-2-yl)-1-piperidyl]-N-(4-ethyl-5-methyl-thiazol-2-yl)acetamide 2-[(2R)-2-(1,3-dioxolan-2-yl)-1-…

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) 2.28 4.67 -10.54 1 6 0 64 339.461 5 ↓
Mid Mid (pH 6-8) 2.28 6.64 -38.2 2 6 1 65 340.469 5 ↓

Activity (Go SEA)

Rings

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

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