KL-1333

Search structure
Synonyms:
Status: Phase 1
Entry Type: Small molecule
Molecule Category: UNKNOWN
UNII: NA2ZOL5UGM

Structure
InChI Key AJFWITSBVLLDCC-UHFFFAOYSA-N
Smile CC(C)c1nc2c([nH]1)C(=O)C(=O)c1ccccc1-2
InChI
InChI=1S/C14H12N2O2/c1-7(2)14-15-10-8-5-3-4-6-9(8)12(17)13(18)11(10)16-14/h3-7H,1-2H3,(H,15,16)

Physicochemical Descriptors

Property Name Value
Molecular Formula C14H12N2O2
Molecular Weight 240.26
AlogP 2.58
Hydrogen Bond Acceptor 3.0
Hydrogen Bond Donor 1.0
Number of Rotational Bond 1.0
Polar Surface Area 62.82
Molecular species NEUTRAL
Aromatic Rings 2.0
Heavy Atoms 18.0

Indications

Mesh Heading Maximum Phase Mesh ID Reference
MELAS Syndrome 1 D017241 ClinicalTrials
Mitochondrial Diseases 1 D028361 ClinicalTrials

Cross References

Resources Reference
ChEMBL CHEMBL4594430
FDA SRS NA2ZOL5UGM
PubChem 91820639
SureChEMBL SCHEMBL16878775
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