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Compound Detail

CHEMBL5747391

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C[C@H]1CN(C)CC[C@@H]1NC(=O)C(C)(C)COc1ccccc1Cl
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL5747391
Phase Preclinical
Structure Type MOL
InChI Key AKXSLFQLLMSPLW-ZFWWWQNUSA-N
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

338.9
MW (Da)
3.20
ALogP
3
HBA
1
HBD
41.6
PSA (Ų)
0.90
QED
0
Ro5 Violations
5
Rot. Bonds

Drug Information

Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C18H27ClN2O2
MW 338.88
Aromatic Rings 1
Heavy Atoms 23
NP-Likeness -0.82

Activity Summary

EC50 1 meas. best 8.9

Target Activity Profile

Target Type Best pChEMBL Mean pChEMBL Best (nM) # Data
Somatostatin receptor type 4
CHEMBL1853
 EC50 8.9 8.9 1.3 1

Activity Data Samples

Top measurements by pChEMBL value

Target Type Rel. Value Units pChEMBL Assay PubMed
Somatostatin receptor type 4 EC50 = 1.26 nM 8.9 Inhibition of Forskolin Stimulated cAMP in Cells Overexpressing SSTR4: This cell... -

Data from ChEMBL 36 via Core Engine