Details of the Drug

General Information of Drug (ID: DMYCH0G)

Drug Name
ZINC584606052
Synonyms
SCHEMBL17492363; YDADFGXXCHDXFC-UHFFFAOYSA-N; US10077269, Example 5; BDBM285532; ZINC584606052; 3-(6-cyanopyridin-3-yl)-N-cyclopropylimidazo[1,2-b]pyridazine-2-carboxamide; 3-(6-Cyanopyridin-3-yl)-N-cyclopropylimidazo[1,2-b]pyridazine-2-carboxamide (5)
Drug Type
Small molecular drug
Structure
3D MOL 2D MOL
#Ro5 Violations (Lipinski): 0 Molecular Weight (mw) 304.31
Logarithm of the Partition Coefficient (xlogp) 1.1
Rotatable Bond Count (rotbonds) 3
Hydrogen Bond Donor Count (hbonddonor) 1
Hydrogen Bond Acceptor Count (hbondacc) 5
Chemical Identifiers
Formula
C16H12N6O
IUPAC Name
3-(6-cyanopyridin-3-yl)-N-cyclopropylimidazo[1,2-b]pyridazine-2-carboxamide
Canonical SMILES
C1CC1NC(=O)C2=C(N3C(=N2)C=CC=N3)C4=CN=C(C=C4)C#N
InChI
InChI=1S/C16H12N6O/c17-8-12-4-3-10(9-18-12)15-14(16(23)20-11-5-6-11)21-13-2-1-7-19-22(13)15/h1-4,7,9,11H,5-6H2,(H,20,23)
InChIKey
YDADFGXXCHDXFC-UHFFFAOYSA-N
Cross-matching ID
PubChem CID
118863059
ChEBI ID
CHEMBL5811282
TTD ID
D04VJX
Drug-Molecule Activity Atlas (DMA)NEW Click to Jump to the Detailed DMA Information of This Drug

Molecular Interaction Atlas of This Drug


Drug Therapeutic Target (DTT)
DTT Name DTT ID UniProt ID MOA REF
Phosphodiesterase 4C (PDE4C) TT6A59G PDE4C_HUMAN Inhibitor [1]
Molecular Interaction Atlas (MIA) Jump to Detail Molecular Interaction Atlas of This Drug

References

1 Imidazopyridazine compounds. US9598421.