JNJ-42396302

Search structure
Synonyms:
Status: Phase 1
Entry Type: Small molecule
Molecule Category: UNKNOWN
UNII: P5M4972608

Structure
InChI Key BPLVDYJDAVYLRQ-UHFFFAOYSA-N
Smile COCCc1ccc(-c2c(C)nc3c(N4CCOCC4)ccnn23)cn1
InChI
InChI=1S/C19H23N5O2/c1-14-18(15-3-4-16(20-13-15)6-10-25-2)24-19(22-14)17(5-7-21-24)23-8-11-26-12-9-23/h3-5,7,13H,6,8-12H2,1-2H3

Physicochemical Descriptors

Property Name Value
Molecular Formula C19H23N5O2
Molecular Weight 353.43
AlogP 2.13
Hydrogen Bond Acceptor 7.0
Hydrogen Bond Donor 0.0
Number of Rotational Bond 5.0
Polar Surface Area 64.78
Molecular species NEUTRAL
Aromatic Rings 3.0
Heavy Atoms 26.0

Pharmacology

Targets EC50(nM) IC50(nM) Kd(nM) Ki(nM) Inhibition(%)
Enzyme Phosphodiesterase Phosphodiesterase 10 Phosphodiesterase 10A
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Cross References

Resources Reference
CAS NUMBER 1298030-18-8
ChEMBL CHEMBL2180408
DrugBank DB12657
FDA SRS P5M4972608
PubChem 51352628
SureChEMBL SCHEMBL1824885
ZINC ZINC000068268153
CONTENTS