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Compound Detail

CHEMBL1907718

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CC(=O)N1C(Cc2cn(C)c3ccccc23)C(=O)N(C)c2ccccc2[C@@H]1c1ccccc1F
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1907718
Phase Preclinical
Structure Type MOL
InChI Key OOCFWZBXXKLIAF-GEVKEYJPSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
3
Publications
0
Known Names

Molecular Properties

455.5
MW (Da)
4.84
ALogP
3
HBA
0
HBD
45.5
PSA (Ų)
0.44
QED
0
Ro5 Violations
3
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C28H26FN3O2
MW 455.53
Aromatic Rings 4
Heavy Atoms 34
NP-Likeness -0.44

Literature References

PubMed DOI Target Context # Activities
2885419 10.1021/jm00390a019 Cholecystokinin receptor 1
2885419 10.1021/jm00390a019 Cholecystokinin receptor type A 1
2885419 10.1021/jm00390a019 Gastrin/cholecystokinin type B receptor 1

Data from ChEMBL 36 via Core Engine