Synonyms
Status
Molecule Category Free-form
UNII 17VJ76L90T

Structure

InChI Key CNEWKIDCGDXBDE-UHFFFAOYSA-N
Smiles FC(F)(F)c1cccc(C2=CCN(CCc3ccc(-c4ccccc4)cc3)CC2)c1
InChI
InChI=1S/C26H24F3N/c27-26(28,29)25-8-4-7-24(19-25)23-14-17-30(18-15-23)16-13-20-9-11-22(12-10-20)21-5-2-1-3-6-21/h1-12,14,19H,13,15-18H2

Physicochemical Descriptors

Property Name Value
Molecular Formula C26H24F3N
Molecular Weight 407.48
AlogP 6.7
Hydrogen Bond Acceptor 1.0
Number of Rotational Bond 5.0
Polar Surface Area 3.24
Molecular species BASE
Aromatic Rings 3.0
Heavy Atoms 30.0

Related Entries

Cross References

Resources Reference
ChEMBL CHEMBL2107767
DrugBank DB05454
FDA SRS 17VJ76L90T
PubChem 11567682
SureChEMBL SCHEMBL4587135
ZINC ZINC000035826853