Synonyms:
Status: Phase 2
Entry Type: Small molecule
Molecule Category: UNKNOWN
UNII: 6650W303H0

Structure

InChI Key KVHRYLNQDWXAGI-UHFFFAOYSA-N
Smile COc1cn(-c2ccc(-n3cccn3)cc2F)nc(-c2ccnn2-c2ccccc2)c1=O
InChI
InChI=1S/C23H17FN6O2/c1-32-21-15-29(19-9-8-17(14-18(19)24)28-13-5-11-25-28)27-22(23(21)31)20-10-12-26-30(20)16-6-3-2-4-7-16/h2-15H,1H3

Physicochemical Descriptors

Property Name Value
Molecular Formula C23H17FN6O2
Molecular Weight 428.43
AlogP 3.42
Hydrogen Bond Acceptor 8.0
Hydrogen Bond Donor 0.0
Number of Rotational Bond 5.0
Polar Surface Area 79.76
Molecular species NEUTRAL
Aromatic Rings 5.0
Heavy Atoms 32.0

Pharmacology

Action Mechanism of Action Reference
INHIBITOR Phosphodiesterase 10A inhibitor PubMed

Indications

Mesh Heading Maximum Phase Mesh ID Reference
Schizophrenia 2 D012559 ClinicalTrials

Cross References

Resources Reference
ChEMBL CHEMBL3989972
DrugBank DB14774
FDA SRS 6650W303H0
PDB 3K9
PubChem 46848915
SureChEMBL SCHEMBL518714
ZINC ZINC000114005494