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

CHEMBL360981

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
CCCc1ccc(C(=O)Nc2ccc3c(c2)C(C)(c2ccccc2)CC(C)(C)N3C(C)=O)cc1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL360981
Phase Preclinical
Structure Type MOL
InChI Key GUHHQHLOTUGFKQ-UHFFFAOYSA-N
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

454.6
MW (Da)
6.73
ALogP
2
HBA
1
HBD
49.4
PSA (Ų)
0.46
QED
1
Ro5 Violations
5
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C30H34N2O2
MW 454.61
Aromatic Rings 3
Heavy Atoms 34
NP-Likeness -0.58

Activity Summary

IC50 1 meas. best 8.3

Target Activity Profile

Target Type Best pChEMBL Mean pChEMBL Best (nM) # Data
Follicle-stimulating hormone receptor
CHEMBL2024
 IC50 8.3 8.3 5.0 1

Activity Data Samples

Top measurements by pChEMBL value

Target Type Rel. Value Units pChEMBL Assay PubMed
Follicle-stimulating hormone receptor IC50 = 5.0 nM 8.3 In vitro inhibition of maximum response on CHO-K1 cells expressing human Follicl... 15771412

Literature References

PubMed DOI Target Context # Activities
15771412 10.1021/jm049676l Follicle-stimulating hormone receptor 1

Data from ChEMBL 36 via Core Engine