Details of the Drug

General Information of Drug (ID: DM1AU8V)

• Drug Name: Oxindole derivative
• Synonyms: 5-Fluorooxindole; 56341-41-4; 5-fluoroindolin-2-one; 5-Fluoro-2-oxindole; 5-fluoro-1,3-dihydro-2H-indol-2-one; 5-fluoro-1,3-dihydroindol-2-one; 2H-Indol-2-one, 5-fluoro-1,3-dihydro-; 5-fluoro-2,3-dihydro-1H-indol-2-one; 5-Fluoro-1,3-dihydro-indol-2-one; 5-Fluoro-2-indolinone; 5-Fluoro-2,3-dihydro-2-oxoindole; 5-FLUORO-2-OXYINDOLE; 5-Fluoro-2-oxindole, 97%; MFCD02179598; 5-fluoro indoline-2-one; 5-fluoroindolinone; 5-fluoro-oxindole; 5-fluoro oxindole; zlchem 713; FLUOROOXINDOLE; PubChem1687; ACMC-209lrt; AC1MVD5T

Indication

Disease Entry	ICD 11	Status	REF
Malaria	1F40-1F45	Investigative	[1]

• Drug Type: Small molecular drug
• #Ro5 Violations (Lipinski): 0:
  Molecular Weight (mw); 151.14
  Logarithm of the Partition Coefficient (xlogp); 1.3
  Rotatable Bond Count (rotbonds); 0
  Hydrogen Bond Donor Count (hbonddonor); 1
  Hydrogen Bond Acceptor Count (hbondacc); 2
• Chemical Identifiers:
  Formula: C8H6FNO
  IUPAC Name: 5-fluoro-1,3-dihydroindol-2-one
  Canonical SMILES: C1C2=C(C=CC(=C2)F)NC1=O
  InChI: InChI=1S/C8H6FNO/c9-6-1-2-7-5(3-6)4-8(11)10-7/h1-3H,4H2,(H,10,11)
  InChIKey: DDIIYGHHUMKDGI-UHFFFAOYSA-N
• Cross-matching ID:
  PubChem CID: 3731012
  CAS Number: 56341-41-4
  TTD ID: D06YUR

Molecular Interaction Atlas of This Drug

Drug Therapeutic Target (DTT)

DTT Name	DTT ID	UniProt ID	MOA	REF
Plasmodium CDK Pfmrk (Malaria Pfmrk)	TTSFWA7	P90584_PLAFA	Inhibitor	[1]

References

• [1] Novel molecular targets for antimalarial chemotherapy. Int J Antimicrob Agents. 2007 Jul;30(1):4-10.