Details of the Drug

General Information of Drug (ID: DMM5QXL)

• Drug Name: Malonic acid
• Synonyms: malonic acid; propanedioic acid; 141-82-2; Dicarboxymethane; Carboxyacetic acid; Methanedicarboxylic acid; Kyselina malonova; USAF EK-695; Dicarboxylate; Dicarboxylic acid; Kyselina malonova [Czech]; PROPANEDIOLIC ACID; UNII-9KX7ZMG0MK; NSC 8124; METAHNEDICARBOXYLIC ACID; Methanedicarbonic acid; Malonic acid, 99%; Thallium malonate; AI3-15375; 1,3-Propanedioic acid; EINECS 205-503-0; 9KX7ZMG0MK; BRN 1751370; DICARBOXYLIC ACID C3; alpha,omega-Dicarboxylic acid; CHEBI:30794; NSC8124; OFOBLEOULBTSOW-UHFFFAOYSA-N; MFCD00002707; malons

Indication

Disease Entry	ICD 11	Status	REF
Neurodegenerative disorder	8A20-8A23	Investigative	[1]

• Drug Type: Small molecular drug
• #Ro5 Violations (Lipinski): 0:
  Molecular Weight (mw); 104.06
  Logarithm of the Partition Coefficient (xlogp); -0.8
  Rotatable Bond Count (rotbonds); 2
  Hydrogen Bond Donor Count (hbonddonor); 2
  Hydrogen Bond Acceptor Count (hbondacc); 4
• Chemical Identifiers:
  Formula: C3H4O4
  IUPAC Name: propanedioic acid
  Canonical SMILES: C(C(=O)O)C(=O)O
  InChI: InChI=1S/C3H4O4/c4-2(5)1-3(6)7/h1H2,(H,4,5)(H,6,7)
  InChIKey: OFOBLEOULBTSOW-UHFFFAOYSA-N
• Cross-matching ID:
  PubChem CID: 867
  ChEBI ID: CHEBI:30794
  CAS Number: 141-82-2
  DrugBank ID: DB02175
  TTD ID: D08JNG

Molecular Interaction Atlas of This Drug

Drug Therapeutic Target (DTT)

DTT Name	DTT ID	UniProt ID	MOA	REF
Serine Racemase (SRR)	TTZFUY6	SRR_HUMAN	Inhibitor	[1]

References

• [1] Inhibition of human serine racemase, an emerging target for medicinal chemistry. Curr Drug Targets. 2011 Jun;12(7):1037-55.