| Synonyms: | |
| Status: | Approved (1991) |
| Entry Type: | Small molecule |
| Molecule Category: | Parent |
| ATC: | G02CA01 |
| UNII: | I0Q6O6740J |
Structure
| InChI Key | IOVGROKTTNBUGK-SJCJKPOMSA-N |
|---|---|
| Smile | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C17H21NO3 |
| Molecular Weight | 287.36 |
| AlogP | 2.35 |
| Hydrogen Bond Acceptor | 4.0 |
| Hydrogen Bond Donor | 4.0 |
| Number of Rotational Bond | 6.0 |
| Polar Surface Area | 72.72 |
| Molecular species | BASE |
| Aromatic Rings | 2.0 |
| Heavy Atoms | 21.0 |
Pharmacology
| Targets | EC50(nM) | IC50(nM) | Kd(nM) | Ki(nM) | Inhibition(%) | |
|---|---|---|---|---|---|---|
|
Membrane receptor
Family A G protein-coupled receptor
Small molecule receptor (family A GPCR)
Monoamine receptor
Adrenergic receptor
|
191 | 24 | - | - | - |
Indications
| Mesh Heading | Maximum Phase | Reference |
|---|---|---|
| Obstetric Labor, Premature; Premature Birth | Phase 4 | ClinicalTrials |
Related Entries
Scaffolds
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 26652-09-5 |
| ChEBI | 91775 |
| ChEMBL | CHEMBL83063 |
| FDA SRS | I0Q6O6740J |
| Guide to Pharmacology | 7294 |
| PubChem | 688570 |
| SureChEMBL | SCHEMBL4430018 |
CONTENTS