| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 23rd, 2008 | 20 | Yes |
Popular Name: MFCD08692470 MFCD08692470
Find On: PubMed — Wikipedia — Google
CAS Number: 914637-71-1
1-[4-Fluoro-2-(methylsulfonyl)phenyl]piperidine-3-carboxylic acid
1-[4-fluoro-2-(methylsulfonyl)phenyl]piperidine-3-carboxylicacid
| 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) | 1.46 | 4.05 | -56.54 | 0 | 5 | -1 | 78 | 300.331 | 3 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| Warnings | IRRITANT | Matrix Scientific |
No pre-computed analogs available. Try a structural similarity search.