Details of the Drug

General Information of Drug (ID: DMAMV6T)

Drug Name
Sodium sulfamate
Synonyms
Sodium sulfamate; 13845-18-6; Monosodium sulfamate; Sulfamic Acid Sodium Salt; Sulfamic acid, sodium salt; Sulfamic acid, monosodium salt; Sulfamic acid monosodium salt; Aminosulfonic Acid Sodium Salt; Sodium sulphamidate; Sulfamic acid, sodium salt (1:1); Sulphamic acid, sodium salt; Sodium Sulphamate; Sodium amidosulfate; EINECS 237-572-8; EINECS 247-584-5; Sodium aminosulfonate; ACMC-209chs; Sulfamicacidmonosodiumsalt; Na.H2NSO3; EC 237-572-8; 26288-34-6; KSC910O5T; DTXSID8065664; KS-00000VNX; CTK8B0759; MolPort-006-120-135
Indication
Disease Entry ICD 11 Status REF
Discovery agent N.A. Investigative [1]
Drug Type
Small molecular drug
Structure
3D MOL 2D MOL
#Ro5 Violations (Lipinski):
0		 Molecular Weight 119.08
Logarithm of the Partition Coefficient Not Available
Rotatable Bond Count 0
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 4
Chemical Identifiers
Formula
H2NNaO3S
IUPAC Name
sodium;sulfamate
Canonical SMILES
NS(=O)(=O)[O-].[Na+]
InChI
InChI=1S/H3NO3S.Na/c1-5(2,3)4;/h(H3,1,2,3,4);/q;+1/p-1
InChIKey
QDWYPRSFEZRKDK-UHFFFAOYSA-M
Cross-matching ID
PubChem CID
23700090
CAS Number
13845-18-6
UNII
36KCS0R750
DrugBank ID
DB09472
TTD ID
D0H7JJ

Molecular Interaction Atlas of This Drug


Drug Therapeutic Target (DTT)
DTT Name DTT ID UniProt ID MOA REF
Carbonic anhydrase IV (CA-IV) TTZHA0O CAH4_HUMAN Inhibitor [1]
Molecular Interaction Atlas (MIA) Jump to Detail Molecular Interaction Atlas of This Drug

Molecular Expression Atlas of This Drug

The Studied Disease Discovery agent
ICD Disease Classification N.A.
Molecule Name Molecule Type Gene Name p-value Fold-Change Z-score
Carbonic anhydrase IV (CA-IV) DTT CA4 1.58E-77 -2.02 -1.77
Molecular Expression Atlas (MEA) Jump to Detail Molecular Expression Atlas of This Drug

References

1 Carbonic anhydrase inhibitors: the membrane-associated isoform XV is highly inhibited by inorganic anions. Bioorg Med Chem Lett. 2009 Feb 15;19(4):1155-8.