EcoDrugPlus


Keyword(s):	Food Contact Chemicals
Molecule Category	Free-form
UNII	4WPQ90N53J
EPA CompTox	DTXSID1020516

Keyword(s):

Food Contact Chemicals

Molecule Category

Free-form

UNII

4WPQ90N53J

EPA CompTox

DTXSID1020516


Active Pharmaceutical Ingredients Bioactive chemicals	Exact Similarity SubStructure	Threshold (%) >= 70


InChI Key	RHUYHJGZWVXEHW-UHFFFAOYSA-N
Smiles	CN(C)N
InChI	InChI=1S/C2H8N2/c1-4(2)3/h3H2,1-2H3

InChI Key

RHUYHJGZWVXEHW-UHFFFAOYSA-N

Smiles

CN(C)N

InChI

InChI=1S/C2H8N2/c1-4(2)3/h3H2,1-2H3

Property Name	Value
Molecular Formula	C2H8N2
Molecular Weight	60.07
AlogP	-0.58
Hydrogen Bond Acceptor	2.0
Hydrogen Bond Donor	1.0
Number of Rotational Bond	0.0
Polar Surface Area	29.26
Molecular species	None
Aromatic Rings	0.0
Heavy Atoms	4.0

Property Name

Value

Molecular Formula

C2H8N2

Molecular Weight

60.07

AlogP

-0.58

Hydrogen Bond Acceptor

2.0

Hydrogen Bond Donor

1.0

Number of Rotational Bond

0.0

Polar Surface Area

29.26

Molecular species

None

Aromatic Rings

0.0

Heavy Atoms

4.0

Resources	Reference
CAS NUMBER	57-14-7
NORMAN SUSDAT
FDA SRS	4WPQ90N53J
PubChem	5976
ChemSpider	5756.0

Resources

Reference

CAS NUMBER

57-14-7

NORMAN SUSDAT

FDA SRS

4WPQ90N53J

PubChem

5976

ChemSpider

5756.0


PREMIER has received funding from the 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 this manuscript contains. Elements of the website have been developed under projects PREMIER and the Biocenter Finland Drug Discovery and Chemical Biology network. CSC-IT is thanked for providing computational resources. Content of the website is provided without guarantee for correctness. Data has been collected and integrated from multiple public sources, for the largest: FDA, HUGO Gene Nomenclature Committee, ChEMBL, IUPHAR/BPS guide to pharmacology, Reactome, UniProt, and Ensembl. Credit is given to Ensembl for collecting species images (provided under public domain licences such as Wikimedia and NHGRI).

PREMIER has received funding from the 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 this manuscript contains.

Elements of the website have been developed under projects PREMIER and the Biocenter Finland Drug Discovery and Chemical Biology network. CSC-IT is thanked for providing computational resources. Content of the website is provided without guarantee for correctness. Data has been collected and integrated from multiple public sources, for the largest: FDA, HUGO Gene Nomenclature Committee, ChEMBL, IUPHAR/BPS guide to pharmacology, Reactome, UniProt, and Ensembl. Credit is given to Ensembl for collecting species images (provided under public domain licences such as Wikimedia and NHGRI).

1,1-DIMETHYLHYDRAZINE

Structure

Physicochemical Descriptors

Cross References