Details of the Drug

General Information of Drug (ID: DMS5DHY)

• Drug Name: Cystamine
• Synonyms: Cystamine dihydrochloride; 56-17-7; 2,2'-Disulfanediyldiethanamine dihydrochloride; Ethanamine, 2,2'-dithiobis-, dihydrochloride; Cystamin dihydrochloride; Bis(2-aminoethyl) disulfide dihydrochloride; USAF CB-34; 2-Aminoethyl disulfide dihydrochloride; Cystamine 2HCL; UNII-I90T518457; EINECS 200-260-7; NSC 39322; 2,2'-Dithiodi(ethylammonium) dichloride; Decarboxycystine dihydrochloride; 2,2'-Dithio-bis-(ethylamine) dihydrochloride; Usafcb-34; MFCD00012905; 2-Aminoethyl Dislufide Dihydrochloride

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); 152.3
  Logarithm of the Partition Coefficient (xlogp); -1
  Rotatable Bond Count (rotbonds); 5
  Hydrogen Bond Donor Count (hbonddonor); 2
  Hydrogen Bond Acceptor Count (hbondacc); 4
• Chemical Identifiers:
  Formula: C4H12N2S2
  IUPAC Name: 2-(2-aminoethyldisulfanyl)ethanamine
  Canonical SMILES: C(CSSCCN)N
  InChI: InChI=1S/C4H12N2S2/c5-1-3-7-8-4-2-6/h1-6H2
  InChIKey: APQPRKLAWCIJEK-UHFFFAOYSA-N
• Cross-matching ID:
  PubChem CID: 2915
  ChEBI ID: CHEBI:78757
  CAS Number: 51-85-4
  TTD ID: D0WI3W

Molecular Interaction Atlas of This Drug

Drug Therapeutic Target (DTT)

DTT Name	DTT ID	UniProt ID	MOA	REF
Glutamate--cysteine ligase modifier (GCLM)	TTNFESW	GSH0_HUMAN	Inhibitor	[1]

References

• [1] The gamma-glutamylcysteine synthetase of Onchocerca volvulus. Mol Biochem Parasitol. 2000 Dec;111(2):243-51.