Synonyms:
Status: Approved
Entry Type: Small molecule
Molecule Category: Parent
ATC: G04BX14
UNII: GB2433A4M3

Structure

InChI Key USRHYDPUVLEVMC-FQEVSTJZSA-N
Smile CN(C)[C@@H](CCOc1cccc2ccccc12)c1ccccc1
InChI
InChI=1S/C21H23NO/c1-22(2)20(18-10-4-3-5-11-18)15-16-23-21-14-8-12-17-9-6-7-13-19(17)21/h3-14,20H,15-16H2,1-2H3/t20-/m0/s1

Physicochemical Descriptors

Property Name Value
Molecular Formula C21H23NO
Molecular Weight 305.42
AlogP 4.91
Hydrogen Bond Acceptor 2.0
Hydrogen Bond Donor 0.0
Number of Rotational Bond 6.0
Polar Surface Area 12.47
Molecular species BASE
Aromatic Rings 3.0
Heavy Atoms 23.0

Pharmacology

Action Mechanism of Action Reference
INHIBITOR Serotonin transporter inhibitor PubMed PubMed PubMed PubMed PubMed PMC
Primary Target
SERT

Indications

Mesh Heading Maximum Phase Mesh ID Reference
Erectile Dysfunction 3 D007172 ClinicalTrials
Sexual Dysfunction, Physiological 3 D012735 ClinicalTrials

Related Entries

Scaffolds

Salt

Cross References

Resources Reference
CAS NUMBER 119356-77-3
ChEBI 135962
ChEMBL CHEMBL2110900
DrugBank DB04884
DrugCentral 4381
EPA CompTox DTXSID0057627
FDA SRS GB2433A4M3
Guide to Pharmacology 7901
PharmGKB PA166151992
PubChem 71353
SureChEMBL SCHEMBL34479
ZINC ZINC000001482019