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Compound Detail

CHEMBL2114461

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CCN1CCC[C@@H]1CNC(=O)c1c(O)c(CCCF)cc(OC)c1OC

Basic Information

ChEMBL ID CHEMBL2114461
Phase Preclinical
Structure Type MOL
InChI Key CUVDIPGTXCBTQZ-CQSZACIVSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

368.4
MW (Da)
2.53
ALogP
5
HBA
2
HBD
71.0
PSA (Ų)
0.70
QED
0
Ro5 Violations
9
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C19H29FN2O4
MW 368.45
Aromatic Rings 1
Heavy Atoms 26
NP-Likeness -0.28

Literature References

PubMed DOI Target Context # Activities
1827843 10.1021/jm00109a013 D(2) dopamine receptor 2

Data from ChEMBL 36 via Core Engine