Synonyms:
Status: Phase 3
Entry Type: Small molecule
Molecule Category: UNKNOWN
ATC: N07XX03
UNII: V8QL94KNQO

Structure

InChI Key WJJYZXPHLSLMGE-UHFFFAOYSA-N
Smile FC(F)(F)c1cccc(C2=CCN(CCc3ccc4ccccc4c3)CC2)c1
InChI
InChI=1S/C24H22F3N/c25-24(26,27)23-7-3-6-22(17-23)20-11-14-28(15-12-20)13-10-18-8-9-19-4-1-2-5-21(19)16-18/h1-9,11,16-17H,10,12-15H2

Physicochemical Descriptors

Property Name Value
Molecular Formula C24H22F3N
Molecular Weight 381.44
AlogP 6.19
Hydrogen Bond Acceptor 1.0
Hydrogen Bond Donor 0.0
Number of Rotational Bond 4.0
Polar Surface Area 3.24
Molecular species BASE
Aromatic Rings 3.0
Heavy Atoms 28.0

Pharmacology

Action Mechanism of Action Reference
AGONIST Serotonin 1a (5-HT1a) receptor agonist PubMed PubMed PubMed Other

Indications

Mesh Heading Maximum Phase Mesh ID Reference
Alzheimer Disease 3 D000544 ClinicalTrials
Colorectal Neoplasms 3 D015179 ClinicalTrials

Related Entries

Scaffolds

Cross References

Resources Reference
CAS NUMBER 135354-02-8
ChEBI 48520
ChEMBL CHEMBL1512580
DrugBank DB06393
EPA CompTox DTXSID9048306
FDA SRS V8QL94KNQO
PubChem 128919
SureChEMBL SCHEMBL137094
ZINC ZINC000000577115