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

CHEMBL4160259

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
COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(CC(N)C3CCN(C)CC3)c2=O)c1F
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL4160259
Phase Preclinical
Structure Type MOL
InChI Key XIDPLLZWBXZAIQ-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

516.6
MW (Da)
3.13
ALogP
7
HBA
1
HBD
82.5
PSA (Ų)
0.52
QED
1
Ro5 Violations
7
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C27H31F3N4O3
MW 516.56
Aromatic Rings 3
Heavy Atoms 37
NP-Likeness -0.77

Literature References

PubMed DOI Target Context # Activities
29335207 10.1016/j.ejmech.2017.12.095 Gonadotropin-releasing hormone receptor 1

Data from ChEMBL 36 via Core Engine