UCSF

ZINC66859102

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
September 2nd, 2011 25 Yes

Popular Name: N-methyl-N-[1-[[2-oxo-5-(2-thienyl)-1,3,4-oxadiazol-3-yl]methyl]-4-piperidyl]ethanesulfonamide N-methyl-N-[1-[[2-oxo-5-(2-thien…

Find On: PubMed — Wikipedia — Google

Download: MOL2 SDF SMILES Flexibase

Annotations

None

Vendors

    None

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) 1.29 4.32 -47.71 1 8 1 90 387.507 6 ↓
Mid Mid (pH 6-8) 1.29 1.85 -14.72 0 8 0 89 386.499 6 ↓

Activity (Go SEA)

Rings

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

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