| Synonyms: | |
| Status: | Phase 1 |
| Entry Type: | Small molecule |
| Molecule Category: | UNKNOWN |
| UNII: | 03N9U5JAF6 |
Structure
| InChI Key | HSWPZIDYAHLZDD-UHFFFAOYSA-N |
|---|---|
| Smile | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C14H16N2 |
| Molecular Weight | 212.3 |
| AlogP | 2.86 |
| Hydrogen Bond Acceptor | 1.0 |
| Hydrogen Bond Donor | 1.0 |
| Number of Rotational Bond | 2.0 |
| Polar Surface Area | 28.68 |
| Molecular species | NEUTRAL |
| Aromatic Rings | 2.0 |
| Heavy Atoms | 16.0 |
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
|
- | - | - | 1-3 | - |
Related Entries
MCS
Scaffolds
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 104054-27-5 |
| ChEMBL | CHEMBL353972 |
| DrugBank | DB11481 |
| EPA CompTox | DTXSID2049135 |
| FDA SRS | 03N9U5JAF6 |
| PubChem | 71310 |
| SureChEMBL | SCHEMBL304971 |
| ZINC | ZINC000005424171 |
CONTENTS