Synonyms:
Status: Phase 2
Entry Type: Small molecule
Molecule Category: UNKNOWN
UNII: Z5QU38B4V9

Structure

InChI Key ANDGGVOPIJEHOF-UHFFFAOYSA-N
Smile O=C(c1ccc2nccnc2c1)N1CCCCC1
InChI
InChI=1S/C14H15N3O/c18-14(17-8-2-1-3-9-17)11-4-5-12-13(10-11)16-7-6-15-12/h4-7,10H,1-3,8-9H2

Physicochemical Descriptors

Property Name Value
Molecular Formula C14H15N3O
Molecular Weight 241.29
AlogP 2.26
Hydrogen Bond Acceptor 3.0
Hydrogen Bond Donor 0.0
Number of Rotational Bond 1.0
Polar Surface Area 46.09
Molecular species NEUTRAL
Aromatic Rings 2.0
Heavy Atoms 18.0

Pharmacology

Targets EC50(nM) IC50(nM) Kd(nM) Ki(nM) Inhibition(%)
Ion channel Ligand-gated ion channel Ionotropic glutamate receptor AMPA receptor
95000 - - - -

Indications

Mesh Heading Maximum Phase Mesh ID Reference
Cognitive Dysfunction 2 D060825 ClinicalTrials
Schizophrenia 2 D012559 ClinicalTrials

Related Entries

Scaffolds

Cross References

Resources Reference
CAS NUMBER 154235-83-3
ChEBI 34605
ChEMBL CHEMBL136800
DrugBank DB06247
EPA CompTox DTXSID70165574
FDA SRS Z5QU38B4V9
Guide to Pharmacology 4165
KEGG C13675
PDB CX5
PubChem 148184
SureChEMBL SCHEMBL194605
ZINC ZINC000000006489