Synonyms: | |
Status: | Approved (1982) |
Entry Type: | Small molecule |
Molecule Category: | UNKNOWN |
UNII: | C1CG1S3T2W |
InChI Key | MTCUAOILFDZKCO-UHFFFAOYSA-N |
---|---|
Smile | |
InChI |
|
Property Name | Value |
---|---|
Molecular Formula | C16H38N2+2 |
Molecular Weight | 258.49 |
AlogP | 3.52 |
Hydrogen Bond Acceptor | 0.0 |
Hydrogen Bond Donor | 0.0 |
Number of Rotational Bond | 11.0 |
Polar Surface Area | 0.0 |
Molecular species | None |
Aromatic Rings | 0.0 |
Heavy Atoms | 18.0 |
Targets | EC50(nM) | IC50(nM) | Kd(nM) | Ki(nM) | Inhibition(%) | |
---|---|---|---|---|---|---|
Enzyme
Hydrolase
|
- | 5900 | - | 3500 | 0 | |
Membrane receptor
Family A G protein-coupled receptor
Small molecule receptor (family A GPCR)
Monoamine receptor
Histamine receptor
|
- | 820 | - | - | - |
Resources | Reference |
---|---|
ChEBI | 41934 |
ChEMBL | CHEMBL1190 |
DrugBank | DB01245 |
DrugCentral | 789 |
EPA CompTox | DTXSID5048394 |
FDA SRS | C1CG1S3T2W |
Human Metabolome Database | HMDB0015375 |
KEGG | C11733 |
PDB | DME |
PharmGKB | PA164747980 |
PubChem | 2968 |
SureChEMBL | SCHEMBL238400 |
ZINC | ZINC000001532339 |