Details of the Drug

General Information of Drug (ID: DM2K6YU)

• Drug Name: US8546370, 11
• Synonyms: SCHEMBL1044792; CHEMBL3642577; BDBM103510; US8546370, 11
• Drug Type: Small molecular drug
• #Ro5 Violations (Lipinski): 0:
  Molecular Weight (mw); 398.5
  Logarithm of the Partition Coefficient (xlogp); 3.6
  Rotatable Bond Count (rotbonds); 4
  Hydrogen Bond Donor Count (hbonddonor); 2
  Hydrogen Bond Acceptor Count (hbondacc); 5
• Chemical Identifiers:
  Formula: C24H22N4O2
  IUPAC Name: 8-(4-morpholin-4-ylanilino)-6-phenyl-2H-2,7-naphthyridin-1-one
  Canonical SMILES: C1COCCN1C2=CC=C(C=C2)NC3=C4C(=CC(=N3)C5=CC=CC=C5)C=CNC4=O
  InChI: InChI=1S/C24H22N4O2/c29-24-22-18(10-11-25-24)16-21(17-4-2-1-3-5-17)27-23(22)26-19-6-8-20(9-7-19)28-12-14-30-15-13-28/h1-11,16H,12-15H2,(H,25,29)(H,26,27)
  InChIKey: UNLNOESEDGPPCS-UHFFFAOYSA-N
• Cross-matching ID:
  PubChem CID: 44193817
  TTD ID: D09OGH

Molecular Interaction Atlas of This Drug

Drug Therapeutic Target (DTT)

DTT Name	DTT ID	UniProt ID	MOA	REF
Tyrosine-protein kinase ZAP-70 (ZAP-70)	TTUMHT8	ZAP70_HUMAN	Inhibitor	[1]

References

• [1] Compounds and compositions as kinase inhibitors. US8546370.