EcoDrugPlus


Trade Names	MAOLATE
Synonyms	Chlorphenesin Chlorphenesin carbamate Maolate NSC-6401 NSC-82943 U-19,646 U-19646
Status
Molecule Category	Free-form
UNII	HQC4WI89YG
EPA CompTox	DTXSID5022803


InChI Key	SKPLBLUECSEIFO-UHFFFAOYSA-N
Smiles	NC(=O)OCC(O)COc1ccc(Cl)cc1
InChI	InChI=1S/C10H12ClNO4/c11-7-1-3-9(4-2-7)15-5-8(13)6-16-10(12)14/h1-4,8,13H,5-6H2,(H2,12,14)

Property Name	Value
Molecular Formula	C10H12ClNO4
Molecular Weight	245.66
AlogP	1.17
Hydrogen Bond Acceptor	4.0
Hydrogen Bond Donor	2.0
Number of Rotational Bond	5.0
Polar Surface Area	81.78
Molecular species	NEUTRAL
Aromatic Rings	1.0
Heavy Atoms	16.0

Targets	EC50(nM)	IC50(nM)	Kd(nM)	Ki(nM)	Inhibition(%)
Enzyme Oxidoreductase	-	-	-	-	47

	EC50(nM)	IC50(nM)	Kd(nM)	Ki(nM)	Inhibition(%)
Homo sapiens	-	-	-	-	47

Resources	Reference
ChEBI	3643
ChEMBL	CHEMBL607710
DrugBank	DB14656
DrugCentral	614
FDA SRS	HQC4WI89YG
KEGG	C07930
PubChem	2724
SureChEMBL	SCHEMBL34492

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

CHLORPHENESIN CARBAMATE

Structure

Physicochemical Descriptors

Pharmacology

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