EcoDrugPlus


Synonyms	LAA-M LAAM Levacetylmethadol Levo-alphacetylmethadol Levoacetyl methadol Levomethadyl acetate
Status
Molecule Category	Free-form
UNII	R3B637Y991
EPA CompTox	DTXSID3023211


InChI Key	XBMIVRRWGCYBTQ-AVRDEDQJSA-N
Smiles	CC[C@H](OC(C)=O)C(C[C@H](C)N(C)C)(c1ccccc1)c1ccccc1
InChI	InChI=1S/C23H31NO2/c1-6-22(26-19(3)25)23(17-18(2)24(4)5,20-13-9-7-10-14-20)21-15-11-8-12-16-21/h7-16,18,22H,6,17H2,1-5H3/t18-,22-/m0/s1

Property Name	Value
Molecular Formula	C23H31NO2
Molecular Weight	353.51
AlogP	4.65
Hydrogen Bond Acceptor	3.0
Number of Rotational Bond	8.0
Polar Surface Area	29.54
Molecular species	BASE
Aromatic Rings	2.0
Heavy Atoms	26.0

Resources	Reference
ChEBI	6441
ChEMBL	CHEMBL1514
DrugBank	DB01227
DrugCentral	1571
FDA SRS	R3B637Y991
Human Metabolome Database	HMDB0015358
Guide to Pharmacology	7212
KEGG	C08012
PharmGKB	PA450215
PubChem	15130
SureChEMBL	SCHEMBL93805
ZINC	ZINC000001530967

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

LEVOMETHADYL ACETATE

Structure

Physicochemical Descriptors

Related Entries

Cross References