EcoDrugPlus


Synonyms	Contezolid MRX-1 MRX-I Mrx-i
Status
Molecule Category	Free-form
UNII	B669M62ELP

Synonyms

Contezolid

MRX-1

MRX-I

Mrx-i

Status

Molecule Category

Free-form

UNII

B669M62ELP


InChI Key	SULYVXZZUMRQAX-NSHDSACASA-N
Smiles	O=C1C=CN(c2c(F)cc(N3C[C@H](CNc4ccon4)OC3=O)c(F)c2F)CC1
InChI	InChI=1S/C18H15F3N4O4/c19-12-7-13(15(20)16(21)17(12)24-4-1-10(26)2-5-24)25-9-11(29-18(25)27)8-22-14-3-6-28-23-14/h1,3-4,6-7,11H,2,5,8-9H2,(H,22,23)/t11-/m0/s1

InChI Key

SULYVXZZUMRQAX-NSHDSACASA-N

Smiles

O=C1C=CN(c2c(F)cc(N3C[C@H](CNc4ccon4)OC3=O)c(F)c2F)CC1

InChI

InChI=1S/C18H15F3N4O4/c19-12-7-13(15(20)16(21)17(12)24-4-1-10(26)2-5-24)25-9-11(29-18(25)27)8-22-14-3-6-28-23-14/h1,3-4,6-7,11H,2,5,8-9H2,(H,22,23)/t11-/m0/s1

Property Name	Value
Molecular Formula	C18H15F3N4O4
Molecular Weight	408.34
AlogP	2.82
Hydrogen Bond Acceptor	7.0
Hydrogen Bond Donor	1.0
Number of Rotational Bond	5.0
Polar Surface Area	87.91
Molecular species	NEUTRAL
Aromatic Rings	2.0
Heavy Atoms	29.0

Property Name

Value

Molecular Formula

C18H15F3N4O4

Molecular Weight

408.34

AlogP

2.82

Hydrogen Bond Acceptor

7.0

Hydrogen Bond Donor

1.0

Number of Rotational Bond

5.0

Polar Surface Area

87.91

Molecular species

NEUTRAL

Aromatic Rings

2.0

Heavy Atoms

29.0

Mechanism of Action	Action	Reference
Bacterial 70S ribosome inhibitor	INHIBITOR	PubMed PubMed

Mechanism of Action

Action

Reference

Bacterial 70S ribosome inhibitor

INHIBITOR

PubMed PubMed

Resources	Reference
ChEMBL	CHEMBL3287379
DrugBank	DB12796
FDA SRS	B669M62ELP
Guide to Pharmacology	10795
PDB	ZC0
PubChem	25184541
SureChEMBL	SCHEMBL5945221

Resources

Reference

ChEMBL

CHEMBL3287379

DrugBank

DB12796

FDA SRS

B669M62ELP

Guide to Pharmacology

PDB

PubChem

SureChEMBL

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

CONTEZOLID

Structure

Physicochemical Descriptors

Pharmacology

Cross References