KETAMINE


Synonyms	Anaket v Calypsol Clorketam 1000 Dl-ketamine Imalgene 1000 Ketalar Ketamine Ketasol 100 NSC-70151 Narketan PMI-150 Tekam Ursotamin Vetaket
Status
Molecule Category	Free-form
ATC	N01AX03
UNII	690G0D6V8H
EPA CompTox	DTXSID8023187


InChI Key	YQEZLKZALYSWHR-UHFFFAOYSA-N
Smiles	CNC1(c2ccccc2Cl)CCCCC1=O
InChI	InChI=1S/C13H16ClNO/c1-15-13(9-5-4-8-12(13)16)10-6-2-3-7-11(10)14/h2-3,6-7,15H,4-5,8-9H2,1H3

Property Name	Value
Molecular Formula	C13H16ClNO
Molecular Weight	237.73
AlogP	2.9
Hydrogen Bond Acceptor	2.0
Hydrogen Bond Donor	1.0
Number of Rotational Bond	2.0
Polar Surface Area	29.1
Molecular species	NEUTRAL
Aromatic Rings	1.0
Heavy Atoms	16.0

Targets	EC50(nM)	IC50(nM)	Kd(nM)	Ki(nM)	Inhibition(%)
Ion channel Ligand-gated ion channel Ionotropic glutamate receptor NMDA receptor	-	610-860	-	180-420	-
Ion channel Ligand-gated ion channel Nicotinic acetylcholine receptor Nicotinic acetylcholine receptor alpha subunit	-	-	-	-	0.1
Ion channel Voltage-gated ion channel Potassium channels Two-pore domain potassium channel	-	-	-	-	7.3

	EC50(nM)	IC50(nM)	Kd(nM)	Ki(nM)	Inhibition(%)
Canis lupus familiaris	-	-	-	180-180	-
Cavia porcellus	-	-	-	180	-
Homo sapiens	-	-	-	180-180	7.3
Mus musculus	-	-	-	180	-
Rattus norvegicus	-	610-700	-	180-180	-
Torpedo nobiliana	-	-	-	-	0.1

Header

Compound Name

Maximum Phase

Compound Structure

Smile

Inchi

InchiKey

Compound Properties

Molecular Formula

Molecular Weight

ALogP

PSA

Countries
Croatia
Germany
Hungary
Romania
Slovenia

Resources	Reference
ChEBI	6121
ChEMBL	CHEMBL742
DrugBank	DB01221
DrugCentral	1523
FDA SRS	690G0D6V8H
Human Metabolome Database	HMDB0015352
Guide to Pharmacology	4233
KEGG	C07525
PharmGKB	PA450144
PubChem	3821
SureChEMBL	SCHEMBL17084881

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...

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Last update: Monday, 3 November 2025

KETAMINE

Structure

Physicochemical Descriptors

Pharmacology

Related Entries

Environmental Exposure

Cross References