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Compound Detail

CHEMBL3545280

EFATUTAZONE
🧪 Phase II
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🧪 Phase II
Cc1cc(Oc2ccc3nc(COc4ccc(CC5SC(=O)NC5=O)cc4)n(C)c3c2)cc(C)c1N

Basic Information

ChEMBL ID CHEMBL3545280
Name EFATUTAZONE
Phase Phase II
Structure Type MOL
InChI Key JCYNMRJCUYVDBC-UHFFFAOYSA-N

Known Names

CS-7017 ANHYDROUS Efatutazona Efatutazone Inolitazone
1
Targets
2
Activities
1
Assay Types
0
PK Parameters
3
Publications
4
Known Names
8
Indications

Molecular Properties

502.6
MW (Da)
5.04
ALogP
8
HBA
2
HBD
108.5
PSA (Ų)
0.34
QED
2
Ro5 Violations
7
Rot. Bonds

Drug Information

Molecule Type Small molecule
Chirality Racemic

Flags

Natural Product
USAN Stem ef-

Extended Properties

Molecular Formula C27H26N4O4S
MW 502.60
Aromatic Rings 4
Heavy Atoms 36
NP-Likeness -0.71

Indications

Carcinoma, Non-Small-Cell Lung Colorectal Neoplasms Colorectal Neoplasms Liposarcoma Thyroid Neoplasms Multiple Myeloma Neoplasms Neoplasms

Activity Summary

EC50 2 meas. best 10.42

Target Activity Profile

Target Type Best pChEMBL Mean pChEMBL Best (nM) # Data
Peroxisome proliferator-activated receptor gamma
CHEMBL235
EC50 10.42 9.71 0.0 2

Activity Data Samples

Top measurements by pChEMBL value

Literature References

PubMed DOI Target Context # Activities
30241907 10.1016/j.bmc.2018.09.006 Peroxisome proliferator-activated receptor gamma 2
30351933 10.1021/acs.jmedchem.8b01200 Peroxisome proliferator-activated receptor gamma 1
30351933 10.1021/acs.jmedchem.8b01200 Unchecked 1

Data from ChEMBL 36 via Core Engine