nimesulide
- CAS:
- Other names:
- SMILES: C[S](=O)(=O)Nc1ccc(cc1Oc2ccccc2)[N+]([O-])=O
Properties
| MW | HBA | HBD | LogP | TPSA | Rot. | Comp. | Fsp3C | Brutto formula |
|---|---|---|---|---|---|---|---|---|
| 308.31 | 5 | 1 | 4.44 | 109.6 | 5 | 78 | 0.08 | C13H12N2O5S |
Availability
| Suppliers | Supplier IDs | Storage | Storage ID | Quantity | Class | Added |
|---|---|---|---|---|---|---|
| SF_C1667 | None | Jan. 1, 2023 |
Bar codes
| Plate barcode | Sample barcode |
|---|---|
PAINS
| Identified PAINS |
|---|
| Not checked |
Supramolecules
| Name | log K | SD | pH | T(°C) | Method | Ref |
|---|---|---|---|---|---|---|
| [b-Cyclodextrin](1).[nimesulide] | 2.73 | 7.0 | 25.0 | UV-vis spectroscopy | M.I. La Rotonda 2000 | |
| [b-Cyclodextrin](1).[nimesulide] | 2.72 | 7.7 | 25.0 | HPLC-method | Eric Peyrin 2002 | |
| [b-Cyclodextrin](1).[nimesulide] | 2.66 | 7.7 | 30.0 | HPLC-method | Eric Peyrin 2002 | |
| [b-Cyclodextrin](1).[nimesulide] | 2.59 | 7.7 | 35.0 | HPLC-method | Eric Peyrin 2002 | |
| [b-Cyclodextrin](1).[nimesulide] | 2.55 | 7.7 | 40.0 | HPLC-method | Eric Peyrin 2002 | |