UCSF

ZINC38536675

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
January 26th, 2010 15 Yes

Popular Name: (S)-2-Phenyl-1-pyrrolidin-1-ylmethyl-ethylamine (S)-2-Phenyl-1-pyrrolidin-1-ylme…

Find On: PubMed — Wikipedia — Google

CAS Numbers: 200267-75-0 , [200267-75-0]

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) 1.41 6.38 -31.32 3 2 1 30 205.325 4 ↓
Mid Mid (pH 6-8) 1.41 6.78 -121.55 4 2 2 32 206.333 4 ↓

Vendor Notes

Note Type Comments Provided By
Purity 97% Fluorochem
PUBCHEM_PATENT_ID WO1997046553A1 IBM Patent Data

Activity (Go SEA)

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