Details of the Drug

General Information of Drug (ID: DMM4QFL)

• Drug Name: Diethylphosphono Group
• Synonyms: Diethyl phosphonate; 762-04-9; Phosphonic acid, diethyl ester; Phosphonic acid diethyl ester; Diethoxyphosphine oxide; Hydrogen diethyl phosphite; Diethyl acid phosphite; O,O-Diethyl phosphonate; Phosphorous acid, diethyl ester; Ethyl phosphonate ((EtO)2HPO); Diethylfosfit [Czech]; UNII-U9X9YBA22W; NSC 2665; DIETHYLPHOSPHONO GROUP; HSDB 2591; diethoxyphosphino-1-one; diethoxy(oxo)phosphonium; Diethyl phosphite, 98%; EINECS 212-091-6; BRN 0605759; U9X9YBA22W; MJUJXFBTEFXVKU-UHFFFAOYSA-N; Diethylfosfit; MFCD00044573

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); 137.09
  Logarithm of the Partition Coefficient (xlogp); 0.7
  Rotatable Bond Count (rotbonds); 4
  Hydrogen Bond Donor Count (hbonddonor); 0
  Hydrogen Bond Acceptor Count (hbondacc); 3
• Chemical Identifiers:
  Formula: C4H10O3P+
  IUPAC Name: diethoxy(oxo)phosphanium
  Canonical SMILES: CCO[P+](=O)OCC
  InChI: InChI=1S/C4H10O3P/c1-3-6-8(5)7-4-2/h3-4H2,1-2H3/q+1
  InChIKey: LXCYSACZTOKNNS-UHFFFAOYSA-N
• Cross-matching ID:
  PubChem CID: 6327654
  ChEBI ID: CHEBI:41962
  CAS Number: 762-04-9
  DrugBank ID: DB02811
  TTD ID: D06SWV

Molecular Interaction Atlas of This Drug

Drug Therapeutic Target (DTT)

DTT Name	DTT ID	UniProt ID	MOA	REF
Cholinesterase (BCHE)	TTEB0GD	CHLE_HUMAN	Inhibitor	[1]

References

• [1] How many drug targets are there Nat Rev Drug Discov. 2006 Dec;5(12):993-6.