Details of the Drug

General Information of Drug (ID: DM2WUZA)

Drug Name

Sodium maleate

Synonyms

disodium but-2-enedioate; 371-47-1; disodiumfumarate; 2-Butenedioic acid (2Z)-, sodium salt (1:2); ACMC-209ir7; ACMC-209e0o; AC1L1TP7; AC1N5G1J; CTK4D3501; CTK8B1559; CTK4D7533; DTXSID10168802; KS-00000WA6; ANW-22438; ANW-28577; AKOS030228400; AN-18678; 2-Butenedioic acid(2Z)-, sodium salt (1: ); 2-Butenedioic acid(2E)-, sodium salt (1:2)

Indication

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

Small molecular drug

Structure

3D MOL is unavailable

2D MOL

#Ro5 Violations (Lipinski):
0

Molecular Weight

160.04

Logarithm of the Partition Coefficient

Not Available

Rotatable Bond Count

0

Hydrogen Bond Donor Count

0

Hydrogen Bond Acceptor Count

4

Chemical Identifiers

Formula: C4H2Na2O4
IUPAC Name: disodium;(Z)-but-2-enedioate
Canonical SMILES: C(=C\\C(=O)[O-])\\C(=O)[O-].[Na+].[Na+]
InChI: InChI=1S/C4H4O4.2Na/c5-3(6)1-2-4(7)8;;/h1-2H,(H,5,6)(H,7,8);;/q;2*+1/p-2/b2-1-;;
InChIKey: MSJMDZAOKORVFC-UAIGNFCESA-L

Cross-matching ID

PubChem CID: 6364608
ChEBI ID: CHEBI:91263
CAS Number: 371-47-1
TTD ID: D0W2XO

Molecular Interaction Atlas of This Drug

Drug Therapeutic Target (DTT)

DTT Name	DTT ID	UniProt ID	MOA	REF
Carbonic anhydrase (CA)	TTUNARX	NOUNIPROTAC	Inhibitor	[1]

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Molecular Interaction Atlas (MIA)

MIA Detail

Jump to Detail Molecular Interaction Atlas of This Drug

References

1	Carbonic anhydrase inhibitors. Inhibition of the beta-class enzymes from the fungal pathogens Candida albicans and Cryptococcus neoformans with ali... Bioorg Med Chem. 2009 Apr 1;17(7):2654-7.