VABICASERIN

Search structure
Synonyms:
Status: Phase 2
Entry Type: Small molecule
Molecule Category: UNKNOWN
UNII: WD9550HPNL

Structure
InChI Key NPTIPEQJIDTVKR-STQMWFEESA-N
Smile c1cc2c3c(c1)[C@H]1CCC[C@H]1CN3CCNC2
InChI
InChI=1S/C15H20N2/c1-3-11-9-16-7-8-17-10-12-4-2-5-13(12)14(6-1)15(11)17/h1,3,6,12-13,16H,2,4-5,7-10H2/t12-,13-/m0/s1

Physicochemical Descriptors

Property Name Value
Molecular Formula C15H20N2
Molecular Weight 228.34
AlogP 2.49
Hydrogen Bond Acceptor 2.0
Hydrogen Bond Donor 1.0
Number of Rotational Bond 0.0
Polar Surface Area 15.27
Molecular species BASE
Aromatic Rings 1.0
Heavy Atoms 17.0

Pharmacology

Targets EC50(nM) IC50(nM) Kd(nM) Ki(nM) Inhibition(%)
Membrane receptor Family A G protein-coupled receptor Small molecule receptor (family A GPCR) Monoamine receptor Serotonin receptor
8-8 - - 3 -

Indications

Mesh Heading Maximum Phase Mesh ID Reference
Schizophrenia 2 D012559 ClinicalTrials

Cross References

Resources Reference
CAS NUMBER 887258-95-9
ChEMBL CHEMBL2110670
DrugBank DB12071
FDA SRS WD9550HPNL
PubChem 11521822
SureChEMBL SCHEMBL2980790
ZINC ZINC000030691381
CONTENTS