UCSF

ZINC53928261

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
November 27th, 2010 16 Yes

Popular Name: (2R)-2-[[cyclopropyl(2,2,2-trifluoroethyl)amino]methyl]cyclopentanone (2R)-2-[[cyclopropyl(2,2,2-trifl…

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) 2.08 5.56 -5.13 0 2 0 20 235.249 5 ↓
Lo Low (pH 4.5-6) 2.08 7.25 -39.12 1 2 1 22 236.257 5 ↓

Activity (Go SEA)

Rings

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

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