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Compound Detail

CHEMBL144330

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COc1cccc2oc(-c3ccc(C(F)(F)F)cc3)cc(=O)c12
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL144330
Phase Preclinical
Structure Type MOL
InChI Key IDNDWRNGENNTMT-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
2
Publications
0
Known Names

Molecular Properties

320.3
MW (Da)
4.49
ALogP
3
HBA
0
HBD
39.4
PSA (Ų)
0.70
QED
0
Ro5 Violations
2
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C17H11F3O3
MW 320.27
Aromatic Rings 3
Heavy Atoms 23
NP-Likeness 0.06

Literature References

PubMed DOI Target Context # Activities
8523407 10.1021/jm00025a011 Rattus norvegicus 1
23611768 10.1016/j.bmc.2013.03.060 Androgen receptor 1

Data from ChEMBL 36 via Core Engine