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

CHEMBL1765957

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
C=C(c1ccccc1)[C@@]12CN(C)C[C@@H]1CC(CCCCCC)=C2c1ccccc1

Basic Information

ChEMBL ID CHEMBL1765957
Phase Preclinical
Structure Type MOL
InChI Key RVIUUYICERBOIG-XCZPVHLTSA-N
2
Targets
2
Activities
1
Assay Types
0
PK Parameters
3
Publications
0
Known Names

Molecular Properties

385.6
MW (Da)
7.08
ALogP
1
HBA
0
HBD
3.2
PSA (Ų)
0.44
QED
1
Ro5 Violations
8
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C28H35N
MW 385.60
Aromatic Rings 2
Heavy Atoms 29
NP-Likeness 0.52

Activity Summary

EC50 2 meas. best 6.5

Target Activity Profile

Target Type Best pChEMBL Mean pChEMBL Best (nM) # Data
Steroidogenic factor 1
CHEMBL4666
EC50 6.5 6.5 316.2 1
Nuclear receptor subfamily 5 group A member 2
CHEMBL3544
EC50 5.9 5.9 1258.9 1

Activity Data Samples

Top measurements by pChEMBL value

Literature References

PubMed DOI Target Context # Activities
21391689 10.1021/jm1014296 Nuclear receptor subfamily 5 group A member 2 7
21391689 10.1021/jm1014296 Steroidogenic factor 1 7
21391689 10.1021/jm1014296 No relevant target 1

Data from ChEMBL 36 via Core Engine