TROGLITAZONE

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Search structure


Trade Names	PRELAY REZULIN
Synonyms	CI-991 CS-045 GR-92132X GR92132X Prelay Rezulin Romozin Troglitazone
Status
Molecule Category	Free-form
ATC	A10BG01
UNII	I66ZZ0ZN0E
EPA CompTox	DTXSID8023719

Structure


InChI Key	GXPHKUHSUJUWKP-UHFFFAOYSA-N
Smiles	Cc1c(C)c2c(c(C)c1O)CCC(C)(COc1ccc(CC3SC(=O)NC3=O)cc1)O2
InChI	InChI=1S/C24H27NO5S/c1-13-14(2)21-18(15(3)20(13)26)9-10-24(4,30-21)12-29-17-7-5-16(6-8-17)11-19-22(27)25-23(28)31-19/h5-8,19,26H,9-12H2,1-4H3,(H,25,27,28)

Physicochemical Descriptors

Property Name	Value
Molecular Formula	C24H27NO5S
Molecular Weight	441.55
AlogP	4.37
Hydrogen Bond Acceptor	6.0
Hydrogen Bond Donor	2.0
Number of Rotational Bond	5.0
Polar Surface Area	84.86
Molecular species	NEUTRAL
Aromatic Rings	2.0
Heavy Atoms	31.0

Pharmacology

Mechanism of Action	Action	Reference
Peroxisome proliferator-activated receptor gamma agonist	AGONIST	PubMed Wikipedia

Targets	EC50(nM)	IC50(nM)	Kd(nM)	Ki(nM)	Inhibition(%)
Enzyme Cytochrome P450 Cytochrome P450 family 2 Cytochrome P450 family 2C Cytochrome P450 2C19	-	-	-	-	84
Enzyme Phosphatase Protein Phosphatase Tyrosine protein phosphatase	-	-	-	-	29
Ion channel Voltage-gated ion channel Voltage-gated calcium channel	-	800	-	-	-
Transcription factor Nuclear receptor Nuclear hormone receptor subfamily 1 Nuclear hormone receptor subfamily 1 group C Nuclear hormone receptor subfamily 1 group C member 2	-	-	-	-	23.4
Transcription factor Nuclear receptor Nuclear hormone receptor subfamily 1 Nuclear hormone receptor subfamily 1 group C Nuclear hormone receptor subfamily 1 group C member 3	215-980	300-370	-	302-400	96.2
Transporter Electrochemical transporter SLC superfamily of solute carriers SLC22 family of organic cation and anion transporters	-	-	-	-	48.2
Unclassified protein	-	-	-	51.97	-

	EC50(nM)	IC50(nM)	Kd(nM)	Ki(nM)	Inhibition(%)
Cavia porcellus	-	800	-	-	-
Homo sapiens	215-860	300-370	-	51.97-400	23.4-96.2
Mus musculus	130-780	-	-	-	34
Rattus norvegicus	-	53.2	-	-	-

Target Conservation


Protein: Peroxisome proliferator-activated receptor gamma Description: Peroxisome proliferator-activated receptor gamma Organism : Homo sapiens P37231 ENSG00000132170

Cross References

Resources	Reference
CAS NUMBER	97322-87-7
ChEBI	9753
ChEMBL	CHEMBL408
DrugBank	DB00197
DrugCentral	2767
FDA SRS	I66ZZ0ZN0E
Guide to Pharmacology	2693
KEGG	D00395
PDB	TDZ
PharmGKB	PA451799
PubChem	5591
SureChEMBL	SCHEMBL4959
ZINC	ZINC00968279

CONTENTS

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, Volume 54, Issue D1, 6 January 2026, Pages D1397–D1404, https://doi.org/10.1093/nar/gkaf1251

This work is licensed under Creative Commons Attribution-ShareAlike 4.0 International License

Last update: Monday, 27^th July 2026