Details of the Drug

General Information of Drug (ID: DM0ULO2)

• Drug Name: CF602
• Synonyms: UNII-QXA2220N3T; CF-602; 1116652-18-6; QXA2220N3T; SCHEMBL196780; CHEMBL472925; GTPL9447; DTXSID60149702; Cyclohexanecarboxamide, N-(2-((3,4-dichlorophenyl)amino)-4-quinolinyl)-; SB17193

Indication

Disease Entry	ICD 11	Status	REF
Inflammation	1A00-CA43.1	Preclinical	[1]

• Drug Type: Small molecular drug
• #Ro5 Violations (Lipinski): 1:
  Molecular Weight (mw); 414.3
  Logarithm of the Partition Coefficient (xlogp); 6.6
  Rotatable Bond Count (rotbonds); 4
  Hydrogen Bond Donor Count (hbonddonor); 2
  Hydrogen Bond Acceptor Count (hbondacc); 3
• Chemical Identifiers:
  Formula: C22H21Cl2N3O
  IUPAC Name: N-[2-(3,4-dichloroanilino)quinolin-4-yl]cyclohexanecarboxamide
  Canonical SMILES: C1CCC(CC1)C(=O)NC2=CC(=NC3=CC=CC=C32)NC4=CC(=C(C=C4)Cl)Cl
  InChI: InChI=1S/C22H21Cl2N3O/c23-17-11-10-15(12-18(17)24)25-21-13-20(16-8-4-5-9-19(16)26-21)27-22(28)14-6-2-1-3-7-14/h4-5,8-14H,1-3,6-7H2,(H2,25,26,27,28)
  InChIKey: UWEIQVQNNLVOEI-UHFFFAOYSA-N
• Cross-matching ID:
  PubChem CID: 25191023
  CAS Number: 1116652-18-6
  TTD ID: D06PXT

Molecular Interaction Atlas of This Drug

Drug Therapeutic Target (DTT)

DTT Name	DTT ID	UniProt ID	MOA	REF
Adenosine A3 receptor (ADORA3)	TTJFY5U	AA3R_HUMAN	Agonist	[1]

References

• [1] 2011 Pipeline of Can-Fite BioPharm.