Skip to main content
Free research Free research Free compound review with research home and workspace preview
Quick search ChEMBL 36
Compound Detail

CHEMBL117624

Enter ChEMBL ID:
Free Research Context This compound will appear in recent viewed items on the research home for this browser.
Research home View demo workspace
CCC1C(=O)Nc2ccc(-c3cccc(Cl)c3)cc21

Basic Information

ChEMBL ID CHEMBL117624
Phase Preclinical
Structure Type MOL
InChI Key FPXSSMRJZOTADU-UHFFFAOYSA-N
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

271.8
MW (Da)
4.45
ALogP
1
HBA
1
HBD
29.1
PSA (Ų)
0.86
QED
0
Ro5 Violations
2
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C16H14ClNO
MW 271.75
Aromatic Rings 2
Heavy Atoms 19
NP-Likeness -0.48

Activity Summary

IC50 1 meas. best 6.89

Target Activity Profile

Target Type Best pChEMBL Mean pChEMBL Best (nM) # Data
Progesterone receptor
CHEMBL208
IC50 6.89 6.89 130.0 1

Activity Data Samples

Top measurements by pChEMBL value

Target Type Rel. Value Units pChEMBL Assay PubMed
Progesterone receptor IC50 = 130.0 nM 6.89 Progesterone receptor antagonist activity based on its ability to block progeste... 12419390

Literature References

PubMed DOI Target Context # Activities
12419390 10.1016/s0960-894x(02)00746-1 Progesterone receptor 1

Data from ChEMBL 36 via Core Engine