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Compound Detail

CHEMBL5904655

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COC(=O)CCN1CCC(F)(CNC2CC2c2ccccc2)CC1

Basic Information

ChEMBL ID CHEMBL5904655
Phase Preclinical
Structure Type MOL
InChI Key ODMJGVLIRMSRAA-UHFFFAOYSA-N
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

334.4
MW (Da)
2.50
ALogP
4
HBA
1
HBD
41.6
PSA (Ų)
0.78
QED
0
Ro5 Violations
7
Rot. Bonds

Drug Information

Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C19H27FN2O2
MW 334.44
Aromatic Rings 1
Heavy Atoms 24
NP-Likeness -0.60

Activity Summary

IC50 1 meas. best 6.7

Target Activity Profile

Target Type Best pChEMBL Mean pChEMBL Best (nM) # Data
Lysine-specific histone demethylase 1A
CHEMBL6136
IC50 6.7 6.7 202.0 1

Activity Data Samples

Top measurements by pChEMBL value

Data from ChEMBL 36 via Core Engine