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Compound Detail

CHEMBL2364292

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Cc1cc(N(C)C(=O)c2ccc(-c3cccc(F)c3)nc2)ccc1CN1CCN[C@@H](C)C1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL2364292
Phase Preclinical
Structure Type MOL
InChI Key JESBSMVIVFXZDB-IBGZPJMESA-N
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

432.5
MW (Da)
4.27
ALogP
4
HBA
1
HBD
48.5
PSA (Ų)
0.65
QED
0
Ro5 Violations
5
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C26H29FN4O
MW 432.54
Aromatic Rings 3
Heavy Atoms 32
NP-Likeness -1.81

Activity Summary

EC50 1 meas. best 9.6

Target Activity Profile

Target Type Best pChEMBL Mean pChEMBL Best (nM) # Data
Motilin receptor
CHEMBL2203
 EC50 9.6 9.6 0.3 1

Activity Data Samples

Top measurements by pChEMBL value

Target Type Rel. Value Units pChEMBL Assay PubMed
Motilin receptor EC50 = 0.2512 nM 9.6 SUPPLEMENTARY: Agonist activity at human recombinant motilin receptor expressed ... -

Literature References

PubMed DOI Target Context # Activities
- 10.6019/CHEMBL2364262 Motilin receptor 1

Data from ChEMBL 36 via Core Engine