Details of the Drug

General Information of Drug (ID: DMAU80W)

• Drug Name: 3,5,6,8-Tetramethyl-N-Methyl Phenanthrolinium
• Synonyms: 1,3,5,6,8-Pentamethyl-1,10-phenanthrolinium; 1,3,5,6,8-pentamethyl-1,10-phenanthrolin-1-ium; 55247-91-1; AC1Q4YDA; 3,5,6,8-Tetramethyl-N-Methyl Phenanthrolinium; AC1L519F; CTK5A3287; 23624-78-4 (iodide); DB02310; 3,4,6,8-Tetramethyl-N-methyl phenanthrolinium

Indication

Disease Entry	ICD 11	Status	REF
Discovery agent	N.A.	Investigative	[1]

• Drug Type: Small molecular drug
• #Ro5 Violations (Lipinski): 0:
  Molecular Weight (mw); 251.35
  Logarithm of the Partition Coefficient (xlogp); 4
  Rotatable Bond Count (rotbonds); 0
  Hydrogen Bond Donor Count (hbonddonor); 0
  Hydrogen Bond Acceptor Count (hbondacc); 1
• Chemical Identifiers:
  Formula: C17H19N2+
  IUPAC Name: 1,3,5,6,8-pentamethyl-1,10-phenanthrolin-1-ium
  Canonical SMILES: CC1=CC2=C(C3=C(C=C(C=[N+]3C)C)C(=C2C)C)N=C1
  InChI: InChI=1S/C17H19N2/c1-10-6-14-12(3)13(4)15-7-11(2)9-19(5)17(15)16(14)18-8-10/h6-9H,1-5H3/q+1
  InChIKey: FQTUZNACZKILMC-UHFFFAOYSA-N
• Cross-matching ID:
  PubChem CID: 168131
  CAS Number: 55247-91-1
  DrugBank ID: DB02310
  TTD ID: D05YKW

Molecular Interaction Atlas of This Drug

Drug Therapeutic Target (DTT)

DTT Name	DTT ID	UniProt ID	MOA	REF
Methionine aminopeptidase 2 (METAP2)	TTZL0OI	MAP2_HUMAN	Inhibitor	[1]

References

• [1] How many drug targets are there Nat Rev Drug Discov. 2006 Dec;5(12):993-6.