Structure

InChI Key ZXKXJHAOUFHNAS-FVGYRXGTSA-N
Smile CCN[C@@H](C)Cc1cccc(C(F)(F)F)c1.Cl
InChI
InChI=1S/C12H16F3N.ClH/c1-3-16-9(2)7-10-5-4-6-11(8-10)12(13,14)15;/h4-6,8-9,16H,3,7H2,1-2H3;1H/t9-;/m0./s1

Physicochemical Descriptors

Property Name Value
Molecular Formula C12H17ClF3N
Molecular Weight 267.72
AlogP 3.25
Hydrogen Bond Acceptor 1.0
Hydrogen Bond Donor 1.0
Number of Rotational Bond 4.0
Polar Surface Area 12.03
Molecular species BASE
Aromatic Rings 1.0
Heavy Atoms 16.0

Pharmacology

Action Mechanism of Action Reference
AGONIST Serotonin (5-HT) receptor agonist PubMed PubMed PubMed PubMed PubMed PubMed

Cross References

Resources Reference
ChEBI 59730
ChEMBL CHEMBL1887891
EPA CompTox DTXSID7048871
FDA SRS PM28L0FHNP
PubChem 66264
SureChEMBL SCHEMBL120916