| Trade Names: | |
| Synonyms: | |
| Status: | Approved (1986) |
| Entry Type: | Small molecule |
| Molecule Category: | UNKNOWN |
| ATC: | P03AC04 |
| UNII: | 509F88P9SZ |
| InChI Key | RLLPVAHGXHCWKJ-UHFFFAOYSA-N |
|---|---|
| Smile | |
| InChI |
|
| Property Name | Value |
|---|---|
| Molecular Formula | C21H20Cl2O3 |
| Molecular Weight | 391.29 |
| AlogP | 6.11 |
| Hydrogen Bond Acceptor | 3.0 |
| Hydrogen Bond Donor | 0.0 |
| Number of Rotational Bond | 6.0 |
| Polar Surface Area | 35.53 |
| Molecular species | NEUTRAL |
| Aromatic Rings | 2.0 |
| Heavy Atoms | 26.0 |
| Mesh Heading | Maximum Phase | Mesh ID | Reference |
|---|---|---|---|
| Lyme Disease | 3 | D008193 | ClinicalTrials |
| Lice Infestations | 3 | D010373 | ClinicalTrials |
| Resources | Reference |
|---|---|
| CAS NUMBER | 52645-53-1 |
| ChEBI | 34911 |
| ChEMBL | CHEMBL1525 |
| DrugBank | DB04930 |
| DrugCentral | 4152 |
| EPA CompTox | DTXSID8022292 |
| FDA SRS | 509F88P9SZ |
| Human Metabolome Database | HMDB0015604 |
| PharmGKB | PA164743137 |
| PubChem | 40326 |
| SureChEMBL | SCHEMBL26543 |