Details of the Drug

General Information of Drug (ID: DMYZJ5B)

• Drug Name: Acriflavinium chloride
• Synonyms: Acriflavine (component of); Acriflavon; Burnol; Chromoflavine; Flavine; Flavosan; Gonacrine; Gonocrin; Neutroflavine; Panflavin; Trypaflavin; Xanthacridine; ACRIFLAVINIUM HYDROCHLORIDE; 10-methylacridine-3,6-diamine, chloride; 1TW3Q60E36; 3,6-DIAMINO-10-METHYLACRIDINIUM CHLORIDE; 3,6-diamino-10-methylacridin-10-ium chloride; 86-40-8; Acridinium, 3,6-diamino-10-methyl-, chloride; Acridinium, 3,6-diamino-10-methyl-, chloride (1:1); Avlon; C.I. 46000; CCRIS 2116; CHEBI:383703; EINECS 201-668-8; NSC 2755; NSC2755; UNII-1TW3Q60E36
• #Ro5 Violations (Lipinski): 0:
  Molecular Weight; 259.73
  Logarithm of the Partition Coefficient; Not Available
  Rotatable Bond Count; 0
  Hydrogen Bond Donor Count; 2
  Hydrogen Bond Acceptor Count; 3
• Chemical Identifiers:
  Formula: C14H14ClN3
  IUPAC Name: 10-methylacridin-10-ium-3,6-diamine;chloride
  Canonical SMILES: C[N+]1=C2C=C(C=CC2=CC3=C1C=C(C=C3)N)N.[Cl-]
  InChI: KKAJSJJFBSOMGS-UHFFFAOYSA-N
  InChIKey: 1S/C14H13N3.ClH/c1-17-13-7-11(15)4-2-9(13)6-10-3-5-12(16)8-14(10)17;/h2-8H,1H3,(H3,15,16);1H
• Cross-matching ID:
  PubChem CID: 6842
  ChEBI ID: CHEBI:383703
  CAS Number: 86-40-8
  INTEDE ID: DR0043

Molecular Interaction Atlas of This Drug

Drug-Metabolizing Enzyme (DME)

DME Name	DME ID	UniProt ID	MOA	REF
Cytochrome P450 1A1 (CYP1A1)	DE6OQ3W	CP1A1_HUMAN	Substrate	[1]
Cytochrome P450 1A2 (CYP1A2)	DEJGDUW	CP1A2_HUMAN	Substrate	[1]

References

• [1] Activation of the antitumor agent aminoflavone (NSC 686288) is mediated by induction of tumor cell cytochrome P450 1A1/1A2. Mol Pharmacol. 2002 Jul;62(1):143-53.