METOCLOPRAMIDE


Synonyms	Clopra Clopra-"Yellow" Elieten Maxolon Methoxyclopramide Metoclopramide Reglan Terperan
Status
Molecule Category	Free-form
ATC	A03FA01
UNII	L4YEB44I46
EPA CompTox	DTXSID6045169


InChI Key	TTWJBBZEZQICBI-UHFFFAOYSA-N
Smiles	CCN(CC)CCNC(=O)c1cc(Cl)c(N)cc1OC
InChI	InChI=1S/C14H22ClN3O2/c1-4-18(5-2)7-6-17-14(19)10-8-11(15)12(16)9-13(10)20-3/h8-9H,4-7,16H2,1-3H3,(H,17,19)

Property Name	Value
Molecular Formula	C14H22ClN3O2
Molecular Weight	299.8
AlogP	2.0
Hydrogen Bond Acceptor	4.0
Hydrogen Bond Donor	2.0
Number of Rotational Bond	7.0
Polar Surface Area	67.59
Molecular species	BASE
Aromatic Rings	1.0
Heavy Atoms	20.0

Targets	EC50(nM)	IC50(nM)	Kd(nM)	Ki(nM)	Inhibition(%)
Enzyme Cytochrome P450 Cytochrome P450 family 2 Cytochrome P450 family 2D Cytochrome P450 2D6	-	-	-	960	-
Enzyme Oxidoreductase	-	350	-	-	-
Ion channel Ligand-gated ion channel 5HT3 receptor	-	228-880	50.12-79.43	158.49-995	-
Membrane receptor Family A G protein-coupled receptor Small molecule receptor (family A GPCR) Monoamine receptor Dopamine receptor	-	61.3-820	-	27-303	100
Membrane receptor Family A G protein-coupled receptor Small molecule receptor (family A GPCR) Monoamine receptor Serotonin receptor	5.7-794.33	912	-	546-975	-
Transporter Electrochemical transporter SLC superfamily of solute carriers SLC22 family of organic cation and anion transporters	-	-	-	-	52.3

	EC50(nM)	IC50(nM)	Kd(nM)	Ki(nM)	Inhibition(%)
Canis lupus familiaris	-	-	-	-	100-100
Cavia porcellus	5.7	912	-	546	-
Homo sapiens	-	350	-	27-960	52.3
Oryctolagus cuniculus	-	-	50.12-79.43	-	-
Rattus norvegicus	794.33	480-880	-	210-975	14-84

Header

Compound Name

Maximum Phase

Compound Structure

Smile

Inchi

InchiKey

Compound Properties

Molecular Formula

Molecular Weight

ALogP

PSA

Countries
Croatia
Czech Republic
Germany
Hungary
Romania
Serbia
Slovenia

Resources	Reference
ChEBI	107736
ChEMBL	CHEMBL86
DrugBank	DB01233
DrugCentral	1782
FDA SRS	L4YEB44I46
Human Metabolome Database	HMDB0015363
Guide to Pharmacology	241
KEGG	C07868
PharmGKB	PA450475
PubChem	4168
SureChEMBL	SCHEMBL18629
ZINC	ZINC000001530716

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

METOCLOPRAMIDE

Structure

Physicochemical Descriptors

Pharmacology

Related Entries

Environmental Exposure

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