EcoDrugPlus


Synonyms	Dimethyl Formamide
Molecule Category	Free-form
UNII	8696NH0Y2X
Source	Gaulton A, Kale N, van Westen GJ, Bellis LJ, Bento AP, Davies M, Hersey A, Papadatos G, Forster M, Wege P, Overington JP. A large-scale crop protection bioassay data set. Sci Data. 2015 Jul 7;2:150032. Read more ...

Synonyms

Dimethyl Formamide

Molecule Category

Free-form

UNII

Source

Gaulton A, Kale N, van Westen GJ, Bellis LJ, Bento AP, Davies M, Hersey A, Papadatos G, Forster M, Wege P, Overington JP. A large-scale crop protection bioassay data set. Sci Data. 2015 Jul 7;2:150032. Read more ...


InChI Key	ZMXDDKWLCZADIW-UHFFFAOYSA-N
Smiles	CN(C)C=O
InChI	InChI=1S/C3H7NO/c1-4(2)3-5/h3H,1-2H3

InChI Key

ZMXDDKWLCZADIW-UHFFFAOYSA-N

Smiles

CN(C)C=O

InChI

InChI=1S/C3H7NO/c1-4(2)3-5/h3H,1-2H3

Property Name	Value
Molecular Formula	C3H7NO
Molecular Weight	73.09
AlogP	-0.5
Hydrogen Bond Acceptor	1.0
Polar Surface Area	20.31
Molecular species	NEUTRAL
Aromatic Rings	0.0
Heavy Atoms	5.0

Property Name

Value

Molecular Formula

C3H7NO

Molecular Weight

73.09

AlogP

-0.5

Hydrogen Bond Acceptor

1.0

Polar Surface Area

20.31

Molecular species

NEUTRAL

Aromatic Rings

0.0

Heavy Atoms

5.0

	EC50(nM)	IC50(nM)	Kd(nM)	Ki(nM)	Inhibition(%)
Bacillus subtilis	-	-	-	-	3
Escherichia coli	-	-	-	-	2
Pseudomonas aeruginosa	-	-	-	-	0
Staphylococcus aureus	-	-	-	-	6

EC50(nM)

IC50(nM)

Kd(nM)

Ki(nM)

Inhibition(%)

Bacillus subtilis

Escherichia coli

Pseudomonas aeruginosa

Staphylococcus aureus

Resources	Reference
ChEMBL	CHEMBL268291
FDA SRS	8696NH0Y2X
PDB	DMF
PubChem	6228
SureChEMBL	SCHEMBL5
ZINC	ZINC00901648

Resources

Reference

ChEMBL

FDA SRS

PDB

PubChem

SureChEMBL

ZINC

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

DIMETHYLFORMAMIDE

Structure

Physicochemical Descriptors

Pharmacology

Cross References