| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 13th, 2009 | 10 | Yes |
Popular Name: 4,4-difluoropyrrolidine-2-carboxylic acid 4,4-difluoropyrrolidine-2-carbox…
Find On: PubMed — Wikipedia — Google
CAS Numbers: 1073555-68-6 , 1354949-90-8 , 1373255-09-4 , 52683-81-5
(R)-4,4-difluoropyrrolidine-2-carboxylic acid hydrochloride
(S)-4,4-Difluoropyrrolidine-2-carboxylicacid
(S)-4,4-Difluoropyrrolidine-2-carboxylicacidcompoundwith2,2,2-trifluoroaceticacid(1:1)
| 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) | -1.35 | 1.62 | -40.6 | 2 | 3 | 0 | 57 | 151.112 | 1 | ↓ |
| Hi High (pH 8-9.5) | -1.35 | 0.26 | -39.79 | 1 | 3 | -1 | 52 | 150.104 | 1 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
| PUBCHEM_PATENT_ID | WO2000071572A1 | IBM Patent Data |
No pre-computed analogs available. Try a structural similarity search.