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

CHEMBL6027712

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
CC[C@H]1CN(C)CC[C@@H]1NC(=O)C(C)(C)COc1ncccc1C(F)(F)F

Basic Information

ChEMBL ID CHEMBL6027712
Phase Preclinical
Structure Type MOL
InChI Key DPELDKGRMRSMKY-ZFWWWQNUSA-N
2
Targets
4
Activities
2
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

387.4
MW (Da)
3.35
ALogP
4
HBA
1
HBD
54.5
PSA (Ų)
0.81
QED
0
Ro5 Violations
6
Rot. Bonds

Drug Information

Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C19H28F3N3O2
MW 387.45
Aromatic Rings 1
Heavy Atoms 27
NP-Likeness -0.78

Activity Summary

EC50 2 meas. best 9.0
IC50 2 meas. best 7.8

Target Activity Profile

Target Type Best pChEMBL Mean pChEMBL Best (nM) # Data
Somatostatin receptor type 4
CHEMBL1853
EC50 9.0 7.6 1.0 2
Somatostatin receptor type 4
CHEMBL1853
IC50 7.8 7.8 15.8 1
Somatostatin receptor type 1
CHEMBL1917
IC50 5.7 5.7 1995.0 1

Activity Data Samples

Top measurements by pChEMBL value

Data from ChEMBL 36 via Core Engine