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Compound Detail

CHEMBL328332

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CCn1c(O)nc2ccc(-c3cccc(Cl)c3)cc21

Basic Information

ChEMBL ID CHEMBL328332
Phase Preclinical
Structure Type MOL
InChI Key VYFHSRZBQXZWMR-UHFFFAOYSA-N
1
Targets
2
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

272.7
MW (Da)
4.08
ALogP
3
HBA
1
HBD
38.0
PSA (Ų)
0.76
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 C15H13ClN2O
MW 272.74
Aromatic Rings 3
Heavy Atoms 19
NP-Likeness -1.32

Activity Summary

IC50 2 meas. best 7.54

Target Activity Profile

Target Type Best pChEMBL Mean pChEMBL Best (nM) # Data
Progesterone receptor
CHEMBL208
IC50 7.54 7.255 29.2 2

Activity Data Samples

Top measurements by pChEMBL value

Literature References

PubMed DOI Target Context # Activities
11591515 10.1016/s0960-894x(01)00554-6 Progesterone receptor 3

Data from ChEMBL 36 via Core Engine