EcoDrugPlus


Synonyms	BAY-A 9826 BAYER L 1359 BAYER-L-1359 Bilarcil DETF ENT-19,763 Metrifonate Metrifonatum Metriphonate NSC-8923 Trichlorfon Trichlorofon Triclorfon WEC-50
Status
Molecule Category	Free-form
UNII	1MVY4KU98F
EPA CompTox	DTXSID0021389

Synonyms

BAY-A 9826

BAYER L 1359

BAYER-L-1359

Bilarcil

DETF

ENT-19,763

Metrifonate

Metrifonatum

Metriphonate

NSC-8923

Trichlorfon

Trichlorofon

Triclorfon

WEC-50

Status

Molecule Category

Free-form

UNII

1MVY4KU98F

EPA CompTox

DTXSID0021389


InChI Key	NFACJZMKEDPNKN-UHFFFAOYSA-N
Smiles	COP(=O)(OC)C(O)C(Cl)(Cl)Cl
InChI	InChI=1S/C4H8Cl3O4P/c1-10-12(9,11-2)3(8)4(5,6)7/h3,8H,1-2H3

InChI Key

NFACJZMKEDPNKN-UHFFFAOYSA-N

Smiles

COP(=O)(OC)C(O)C(Cl)(Cl)Cl

InChI

InChI=1S/C4H8Cl3O4P/c1-10-12(9,11-2)3(8)4(5,6)7/h3,8H,1-2H3

Property Name	Value
Molecular Formula	C4H8Cl3O4P
Molecular Weight	257.44
AlogP	2.16
Hydrogen Bond Acceptor	4.0
Hydrogen Bond Donor	1.0
Number of Rotational Bond	3.0
Polar Surface Area	55.76
Molecular species	NEUTRAL
Aromatic Rings	0.0
Heavy Atoms	12.0

Property Name

Value

Molecular Formula

C4H8Cl3O4P

Molecular Weight

257.44

AlogP

2.16

Hydrogen Bond Acceptor

4.0

Hydrogen Bond Donor

1.0

Number of Rotational Bond

3.0

Polar Surface Area

55.76

Molecular species

NEUTRAL

Aromatic Rings

0.0

Heavy Atoms

12.0

Mechanism of Action	Action	Reference
Acetylcholinesterase 1 inhibitor	INHIBITOR	PubMed

Mechanism of Action

Action

Reference

Acetylcholinesterase 1 inhibitor

INHIBITOR

PubMed

Resources	Reference
ChEBI	6908
ChEMBL	CHEMBL167150
DrugBank	DB11473
DrugCentral	1787
FDA SRS	1MVY4KU98F
KEGG	C07971
SureChEMBL	SCHEMBL15972

Resources

Reference

ChEBI

ChEMBL

DrugBank

DrugCentral

FDA SRS

KEGG

SureChEMBL

EcoDrug+ was developed under the PREMIER Innovative Medicines Initiative 2 Joint Undertaking (JU) under grant agreement No 875508. The JU receives support from the EU’s Horizon 2020 research and innovation programme and the European Federation of Pharmaceutical Industries and Associations (EFPIA). The views reflect only the authors’ perspective and the JU is not responsible for any use that may be made of the information EcoDrug+ contains.

Elements of EcoDrug+ were developed under the Biocenter Finland Drug Discovery and Chemical Biology network. CSC-IT Center for Science Ltd is thanked for providing computational resources. Credit is given to Ensembl for collecting species images (provided under public domain licences such as Wikimedia and NHGRI).

Content of EcoDrug+ is provided without guarantee for correctness.

Cite Us:

Ashenafi Legehar, Siobhán Monaghan, Mael Briand, Akseli Niemelä, Leo Ghemtio, Ziaurrehman Tanoli, A Ross Brown, Charles R Tyler, Henri Xhaard, EcoDrug PLUS: an advanced database for drug target conservation analysis and environmental risk assessment, Nucleic Acids Research, 2025, gkaf1251 Read...

This work is licensed under Creative Commons Attribution-ShareAlike 4.0 International License

Last update: Monday, 3 November 2025

TRICHLORFON

Structure

Physicochemical Descriptors

Pharmacology

Cross References