| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 25th, 2008 | 22 | No |
Popular Name: 1-[4-(Methylsulfonyl)-2-nitrophenyl]piperidine-4-carboxylic acid 1-[4-(Methylsulfonyl)-2-nitrophe…
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CAS Number: 942474-70-6
1-[4-(Methylsulfonyl)-2-nitrophenyl]piperidine-4-
1-[4-(methylsulfonyl)-2-nitrophenyl]piperidine-4-carboxylicacid
1-[4-(Methylsulphonyl)-2-nitrophenyl]piperidine-4-carboxylic acid
| 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) | 0.82 | 4.9 | -61.52 | 0 | 8 | -1 | 123 | 327.338 | 4 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| Warnings | IRRITANT | Matrix Scientific |
No pre-computed analogs available. Try a structural similarity search.