FLORBENAZINE

Search structure
Status: Phase 2
Entry Type: Small molecule
Molecule Category: UNKNOWN
UNII: K5GDY88W5X

Structure
InChI Key GNKGXQHHUUEYQV-BHIYHBOVSA-N
Smile COc1cc2c(cc1OCCCF)CCN1C[C@@H](CC(C)C)[C@H](O)C[C@H]21
InChI
InChI=1S/C21H32FNO3/c1-14(2)9-16-13-23-7-5-15-10-21(26-8-4-6-22)20(25-3)11-17(15)18(23)12-19(16)24/h10-11,14,16,18-19,24H,4-9,12-13H2,1-3H3/t16-,18-,19-/m1/s1

Physicochemical Descriptors

Property Name Value
Molecular Formula C21H32FNO3
Molecular Weight 365.49
AlogP 3.76
Hydrogen Bond Acceptor 4.0
Hydrogen Bond Donor 1.0
Number of Rotational Bond 7.0
Polar Surface Area 41.93
Molecular species NEUTRAL
Aromatic Rings 1.0
Heavy Atoms 26.0

Pharmacology

Targets EC50(nM) IC50(nM) Kd(nM) Ki(nM) Inhibition(%)
Transporter Electrochemical transporter SLC superfamily of solute carriers SLC18 family of vesicular amine transporters
- - - 0-0 -

Related Entries

Scaffolds

Cross References

Resources Reference
ChEMBL CHEMBL579217
FDA SRS K5GDY88W5X
PubChem 23652686
SureChEMBL SCHEMBL14267523
ZINC ZINC000043205516
CONTENTS