| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 23rd, 2008 | 20 | Yes |
Popular Name: 1-[2-Fluoro-4-(methylsulphonyl)phenyl]piperidine-3-carboxylic acid 1-[2-Fluoro-4-(methylsulphonyl)p…
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CAS Number: 914637-67-5
1-[2-fluoro-4-(methylsulfonyl)phenyl]-3-piperidinecarboxylic acid
1-[2-Fluoro-4-(methylsulfonyl)phenyl]piperidine-3-carboxylic acid
1-[2-fluoro-4-(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) | 1.02 | 3.21 | -53.51 | 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.