Synonyms | |
Status | |
Molecule Category | Free-form |
ATC | N05CD01 |
UNII | IHP475989U |
EPA CompTox | DTXSID1023071 |
InChI Key | SAADBVWGJQAEFS-UHFFFAOYSA-N | |
---|---|---|
Smiles | ||
InChI |
|
Property Name | Value | |
---|---|---|
Molecular Formula | C21H23ClFN3O | |
Molecular Weight | 387.89 | |
AlogP | 4.0 | |
Hydrogen Bond Acceptor | 3.0 | |
Hydrogen Bond Donor | 0.0 | |
Number of Rotational Bond | 6.0 | |
Polar Surface Area | 35.91 | |
Molecular species | BASE | |
Aromatic Rings | 2.0 | |
Heavy Atoms | 27.0 |
Resources | Reference | |
---|---|---|
ChEBI | 5128 | |
ChEMBL | CHEMBL968 | |
DrugBank | DB00690 | |
DrugCentral | 1218 | |
FDA SRS | IHP475989U | |
Human Metabolome Database | HMDB0014828 | |
Guide to Pharmacology | 7188 | |
PDB | FL7 | |
PharmGKB | PA449681 | |
PubChem | 3393 | |
SureChEMBL | SCHEMBL29793 | |
ZINC | ZINC000000537752 |