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Compound Detail

CHEMBL579217

FLORBENAZINE
🧪 Phase II
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🧪 Phase II
COc1cc2c(cc1OCCCF)CCN1C[C@@H](CC(C)C)[C@H](O)C[C@H]21

Basic Information

ChEMBL ID CHEMBL579217
Name FLORBENAZINE
Phase Phase II
Structure Type MOL
InChI Key GNKGXQHHUUEYQV-BHIYHBOVSA-N
2
Targets
4
Activities
1
Assay Types
0
PK Parameters
3
Publications
0
Known Names

Molecular Properties

365.5
MW (Da)
3.76
ALogP
4
HBA
1
HBD
41.9
PSA (Ų)
0.75
QED
0
Ro5 Violations
7
Rot. Bonds

Drug Information

Molecule Type Small molecule
Chirality Single Enantiomer
USAN Year 2010

Extended Properties

Molecular Formula C21H32FNO3
MW 365.49
Aromatic Rings 1
Heavy Atoms 26
NP-Likeness 0.83

Activity Summary

Ki 4 meas. best 10.0

Target Activity Profile

Target Type Best pChEMBL Mean pChEMBL Best (nM) # Data
Synaptic vesicular amine transporter
CHEMBL1893
Ki 10.0 10.0 0.1 1
Synaptic vesicular amine transporter
CHEMBL4828
Ki 10.0 9.6867 0.1 3

Activity Data Samples

Top measurements by pChEMBL value

Literature References

PubMed DOI Target Context # Activities
19632829 10.1016/j.bmcl.2009.07.048 Synaptic vesicular amine transporter 3
19632829 10.1016/j.bmcl.2009.07.048 ADMET 1
21531556 10.1016/j.bmcl.2011.03.113 Synaptic vesicular amine transporter 1

Data from ChEMBL 36 via Core Engine