Synonyms: | |
Status: | Approved |
Entry Type: | Small molecule |
Molecule Category: | UNKNOWN |
UNII: | 9UUW4V7G2H |
InChI Key | RHLJLALHBZGAFM-UHFFFAOYSA-N |
---|---|
Smile | |
InChI |
|
Property Name | Value |
---|---|
Molecular Formula | C19H27N5O3 |
Molecular Weight | 373.46 |
AlogP | 2.07 |
Hydrogen Bond Acceptor | 7.0 |
Hydrogen Bond Donor | 1.0 |
Number of Rotational Bond | 5.0 |
Polar Surface Area | 93.81 |
Molecular species | NEUTRAL |
Aromatic Rings | 2.0 |
Heavy Atoms | 27.0 |
Targets | EC50(nM) | IC50(nM) | Kd(nM) | Ki(nM) | Inhibition(%) | |
---|---|---|---|---|---|---|
Ion channel
Voltage-gated ion channel
Voltage-gated calcium channel
|
- | 60000 | - | - | - |
Mesh Heading | Maximum Phase | Reference |
---|---|---|
Essential Hypertension; Hypertension | Phase 4 | ClinicalTrials |
Resources | Reference |
---|---|
CAS NUMBER | 80755-51-7 |
ChEBI | 135576 |
ChEMBL | CHEMBL188185 |
DrugBank | DB12230 |
DrugCentral | 429 |
EPA CompTox | DTXSID7022700 |
FDA SRS | 9UUW4V7G2H |
PubChem | 2472 |
SureChEMBL | SCHEMBL49348 |
ZINC | ZINC000000601249 |