EcoDrugPlus


Synonyms	2-Amino-3-(3,4-Dihydroxy-Phenyl)-2- Methyl-Propionic Acid(Catechol Metabolite) Dl-.alpha.-methyl dopa Dl-methyldopa Methyldopa Methyldopa (racemic) Methyldopa dl-form Racemic .alpha.-methyldopa
Status
Molecule Category	Free-form
ATC	C02AB02
UNII	33TD13T99R


InChI Key	CJCSPKMFHVPWAR-UHFFFAOYSA-N
Smiles	CC(N)(Cc1ccc(O)c(O)c1)C(=O)O
InChI	InChI=1S/C10H13NO4/c1-10(11,9(14)15)5-6-2-3-7(12)8(13)4-6/h2-4,12-13H,5,11H2,1H3,(H,14,15)

Property Name	Value
Molecular Formula	C10H13NO4
Molecular Weight	211.22
AlogP	0.44
Hydrogen Bond Acceptor	4.0
Hydrogen Bond Donor	4.0
Number of Rotational Bond	3.0
Polar Surface Area	103.78
Molecular species	ZWITTERION
Aromatic Rings	1.0
Heavy Atoms	15.0

Resources	Reference
ChEMBL	CHEMBL718
FDA SRS	33TD13T99R
SureChEMBL	SCHEMBL196981

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

METHYLDOPA (RACEMIC)

Structure

Physicochemical Descriptors

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