Details of the Drug

General Information of Drug (ID: DMHT80R)

Drug Name
2-Furan-2-yl-6H-pyrazolo[1,5-c]quinazolin-5-one
Indication
Disease Entry ICD 11 Status REF
Discovery agent N.A. Investigative [1]
Drug Type
Small molecular drug
Structure
3D MOL 2D MOL
#Ro5 Violations (Lipinski): 0 Molecular Weight (mw) 251.24
Logarithm of the Partition Coefficient (xlogp) 2
Rotatable Bond Count (rotbonds) 1
Hydrogen Bond Donor Count (hbonddonor) 1
Hydrogen Bond Acceptor Count (hbondacc) 3
Chemical Identifiers
Formula
C14H9N3O2
IUPAC Name
2-(furan-2-yl)-6H-pyrazolo[1,5-c]quinazolin-5-one
Canonical SMILES
C1=CC=C2C(=C1)C3=CC(=NN3C(=O)N2)C4=CC=CO4
InChI
InChI=1S/C14H9N3O2/c18-14-15-10-5-2-1-4-9(10)12-8-11(16-17(12)14)13-6-3-7-19-13/h1-8H,(H,15,18)
InChIKey
HWHAANIZIAJOCF-UHFFFAOYSA-N
Cross-matching ID
PubChem CID
135511822
ChEBI ID
CHEMBL330394
TTD ID
D04UUT
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Molecular Interaction Atlas of This Drug


Drug Therapeutic Target (DTT)
DTT Name DTT ID UniProt ID MOA REF
GABA(A) receptor alpha-1 (GABRA1) TT1MPAY GBRA1_HUMAN Inhibitor [1]
Gamma-aminobutyric acid receptor (GAR) TTNJYV2 NOUNIPROTAC Inhibitor [1]
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References

1 Synthesis and binding activity of some pyrazolo[1,5-c]quinazolines as tools to verify an optional binding site of a benzodiazepine receptor ligand. J Med Chem. 1996 Jul 19;39(15):2915-21.