UCSF

ZINC66858953

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
September 2nd, 2011 22 No

Popular Name: 2-cyclopentyl-N-[1-[(2-thioxothiazolidin-3-yl)methyl]-4-piperidyl]acetamide 2-cyclopentyl-N-[1-[(2-thioxothi…

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) 2.70 6.66 -17.07 1 4 0 36 341.546 5 ↓
Mid Mid (pH 6-8) 2.70 9.01 -52.83 2 4 1 37 342.554 5 ↓

Activity (Go SEA)

Rings

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

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