Bioactive Compound Details

BioIDbio198927
NameNone
ChEMBL IDCHEMBL507943
Molecular FormulaC4H8Cl2NNaO4S
Molecular Weight260.07
Molecular Weight (Monoisotopic)236.9629
TypeSmall molecule
Max Phase--
Target IDTar81
Target NameNone
Synonyms2-(2-(Dichloroamino)Ethoxy)Ethanesulfonate Sodium
SmilesO=S(=O)([O-])CCOCCN(Cl)Cl.[Na+]
InchiInChI=1S/C4H9Cl2NO4S.Na/c5-7(6)1-2-11-3-4-12(8,9)10;/h1-4H2,(H,8,9,10);/q;+1/p-1
Inchi KeyGQDKVFIZYOQQDM-UHFFFAOYSA-M
Molecular SpeciesACID
Targets1.0
Bioactivities1.0
Np Likeness Score-0.5
Records Key['1k']
Records Name['2-(2-(dichloroamino)ethoxy)ethanesulfonate sodium']
Withdrawn FlagFalse
Orphan-1

Molecular Structure

2D Molecular Structure