PZ-II-029   Click here for help

GtoPdb Ligand ID: 12403

Synonyms: compound 6 [PMID: 23472852] | compound 6 [PMID: 23472935] | PZ II-029
Compound class: Synthetic organic
Comment: PZ-II-029 is an allosteric modulator of GABAA receptors [3-4].
2D Structure
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Physico-chemical Properties
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Hydrogen bond acceptors 2
Hydrogen bond donors 1
Rotatable bonds 3
Topological polar surface area 68.62
Molecular weight 321.11
XLogP 3
No. Lipinski's rules broken 0
SMILES / InChI / InChIKey
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Canonical SMILES COc1ccc(cc1)n1[nH]c2c(c1=O)cnc1c2ccc(c1)OC
Isomeric SMILES COc1ccc(cc1)n1c(=O)c2cnc3cc(ccc3c2[nH]1)OC
InChI InChI=1S/C18H15N3O3/c1-23-12-5-3-11(4-6-12)21-18(22)15-10-19-16-9-13(24-2)7-8-14(16)17(15)20-21/h3-10,20H,1-2H3
InChI Key CGOOCGJMECBDCB-UHFFFAOYSA-N
Classification Click here for help
Compound class Synthetic organic
IUPAC Name Click here for help
7-methoxy-2-(4-methoxyphenyl)-1H-pyrazolo[4,3-c]quinolin-3-one
Synonyms Click here for help
compound 6 [PMID: 23472852] | compound 6 [PMID: 23472935] | PZ II-029
Database Links Click here for help
ChEMBL Ligand CHEMBL43948
GtoPdb PubChem SID 479821194
PubChem CID 10426200
Search Google for chemical match using the InChIKey CGOOCGJMECBDCB-UHFFFAOYSA-N
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UniChem Compound Search for chemical match using the InChIKey CGOOCGJMECBDCB-UHFFFAOYSA-N
UniChem Connectivity Search for chemical match using the InChIKey CGOOCGJMECBDCB-UHFFFAOYSA-N