LUVADAXISTAT

Search structure
Synonyms:
Status: Phase 2
Entry Type: Small molecule
Molecule Category: UNKNOWN
UNII: 76IC00YRVR

Structure
InChI Key QBQMUMMSYHUDFM-UHFFFAOYSA-N
Smile O=c1[nH]nc(CCc2ccc(C(F)(F)F)cc2)cc1O
InChI
InChI=1S/C13H11F3N2O2/c14-13(15,16)9-4-1-8(2-5-9)3-6-10-7-11(19)12(20)18-17-10/h1-2,4-5,7H,3,6H2,(H,17,19)(H,18,20)

Physicochemical Descriptors

Property Name Value
Molecular Formula C13H11F3N2O2
Molecular Weight 284.24
AlogP 2.28
Hydrogen Bond Acceptor 3.0
Hydrogen Bond Donor 2.0
Number of Rotational Bond 3.0
Polar Surface Area 65.98
Molecular species NEUTRAL
Aromatic Rings 2.0
Heavy Atoms 20.0

Pharmacology

Targets EC50(nM) IC50(nM) Kd(nM) Ki(nM) Inhibition(%)
Enzyme Oxidoreductase
- 12-27 - - -

Indications

Mesh Heading Maximum Phase Mesh ID Reference
Schizophrenia 2 D012559 ClinicalTrials
Friedreich Ataxia 2 D005621 ClinicalTrials

Cross References

Resources Reference
ChEMBL CHEMBL2338801
DrugBank DB16067
FDA SRS 76IC00YRVR
PubChem 71270546
SureChEMBL SCHEMBL14719667
ZINC ZINC000095592350
CONTENTS