EcoDrugPlus


Synonyms	Methoxyamine
Status
Molecule Category	Free-form
UNII	9TZH4WY30J
EPA CompTox	DTXSID8043862

Synonyms

Methoxyamine

Status

Molecule Category

Free-form

UNII

9TZH4WY30J

EPA CompTox

DTXSID8043862


InChI Key	GMPKIPWJBDOURN-UHFFFAOYSA-N
Smiles	CON
InChI	InChI=1S/CH5NO/c1-3-2/h2H2,1H3

InChI Key

GMPKIPWJBDOURN-UHFFFAOYSA-N

Smiles

CON

InChI

InChI=1S/CH5NO/c1-3-2/h2H2,1H3

Property Name	Value
Molecular Formula	CH5NO
Molecular Weight	47.06
AlogP	-0.49
Hydrogen Bond Acceptor	2.0
Hydrogen Bond Donor	1.0
Polar Surface Area	35.25
Molecular species	NEUTRAL
Aromatic Rings	0.0
Heavy Atoms	3.0

Property Name

Value

Molecular Formula

CH5NO

Molecular Weight

47.06

AlogP

-0.49

Hydrogen Bond Acceptor

2.0

Hydrogen Bond Donor

1.0

Polar Surface Area

35.25

Molecular species

NEUTRAL

Aromatic Rings

0.0

Heavy Atoms

3.0

	EC50(nM)	IC50(nM)	Kd(nM)	Ki(nM)	Inhibition(%)
Plasmodium falciparum	-	0	-	-	-

EC50(nM)

IC50(nM)

Kd(nM)

Ki(nM)

Inhibition(%)

Plasmodium falciparum

Resources	Reference
ChEMBL	CHEMBL1213633
DrugBank	DB06328
FDA SRS	9TZH4WY30J
PubChem	4113
SureChEMBL	SCHEMBL567

Resources

Reference

ChEMBL

DrugBank

FDA SRS

PubChem

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

METHOXYAMINE

Structure

Physicochemical Descriptors

Pharmacology

Cross References