warfarin
- CAS:
- Other names:
- SMILES: CC(=O)CC(c1ccccc1)C2=C(O)Oc3ccccc3C2=O
Properties
| MW | HBA | HBD | LogP | TPSA | Rot. | Comp. | Fsp3C | Brutto formula |
|---|---|---|---|---|---|---|---|---|
| 308.33 | 3 | 1 | 3.61 | 67.50999999999999 | 4 | 100 | 0.16 | C19H16O4 |
Availability
| Suppliers | Supplier IDs | Storage | Storage ID | Quantity | Class | Added |
|---|---|---|---|---|---|---|
| JN_192 | 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 |
|---|---|---|---|---|---|---|
| [a-Cyclodextrin](1).[warfarin] | 1.58 | 9.5 | 25.0 | fluorescence spectroscopy | Mamoru Kamiya 1997 | |
| [Heptakis(2,6-di-O-Methyl)-b-Cyclodextrin (DS ~14) isomeric purity >50%](1).[warfarin] | 2.45 | 9.5 | 25.0 | fluorescence spectroscopy | Mamoru Kamiya 1997 | |
| [g-Cyclodextrin](1).[warfarin] | 2.28 | 9.5 | 25.0 | fluorescence spectroscopy | Mamoru Kamiya 1997 | |