| Trade Names: | |
| Synonyms: | |
| Status: | Approved (1996) |
| Entry Type: | Small molecule |
| Molecule Category: | Salt |
| UNII: | 4S9CL2DY2H |
| Parent Compound: | BRIMONIDINE |
| InChI Key | QZHBYNSSDLTCRG-UHFFFAOYSA-N |
|---|---|
| Smile | |
| InChI |
|
| Property Name | Value |
|---|---|
| Molecular Formula | C15H16BrN5O6 |
| Molecular Weight | 442.23 |
| AlogP | 1.76 |
| Hydrogen Bond Acceptor | 5.0 |
| Hydrogen Bond Donor | 2.0 |
| Number of Rotational Bond | 1.0 |
| Polar Surface Area | 62.2 |
| Molecular species | NEUTRAL |
| Aromatic Rings | 2.0 |
| Heavy Atoms | 17.0 |
| Mesh Heading | Maximum Phase | Mesh ID | Reference |
|---|---|---|---|
| Glaucoma | 4 | D005901 | ClinicalTrials |
| Erythema | 4 | D004890 | ClinicalTrials |
| Hyperemia | 3 | D006940 | ClinicalTrials |
| Corneal Edema | 3 | D015715 | ClinicalTrials |
| Dry Eye Syndromes | 3 | D015352 | ClinicalTrials |
| Hand-Foot Syndrome | 2 | D060831 | ClinicalTrials |
| Conjunctivitis, Allergic | 2 | D003233 | ClinicalTrials |
| Flushing | 0 | D005483 | ClinicalTrials |
| Alcohol-Related Disorders | 0 | D019973 | ClinicalTrials |
| Resources | Reference |
|---|---|
| ChEBI | 3175 |
| ChEMBL | CHEMBL2062257 |
| FDA SRS | 4S9CL2DY2H |
| Guide to Pharmacology | 520 |
| KEGG | C07886 |
| PubChem | 54405 |
| SureChEMBL | SCHEMBL34649 |
| ZINC | ZINC21303210 |