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Compound Detail

CHEMBL6038611

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Cc1c(-c2cnc(NCc3c(F)ccc4c3CCO4)n3cnnc23)cnn1CCO

Basic Information

ChEMBL ID CHEMBL6038611
Phase Preclinical
Structure Type MOL
InChI Key CFZVHLDMRCTMQP-UHFFFAOYSA-N
2
Targets
6
Activities
1
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

409.4
MW (Da)
1.97
ALogP
9
HBA
2
HBD
102.4
PSA (Ų)
0.50
QED
0
Ro5 Violations
6
Rot. Bonds

Drug Information

Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C20H20FN7O2
MW 409.43
Aromatic Rings 4
Heavy Atoms 30
NP-Likeness -1.56

Activity Summary

IC50 6 meas. best 8.38

Target Activity Profile

Target Type Best pChEMBL Mean pChEMBL Best (nM) # Data
Polycomb protein EED
CHEMBL2189117
IC50 8.38 8.24 4.2 3
EZH2/SUZ12/EED complex
CHEMBL3137286
IC50 8.38 8.24 4.2 3

Activity Data Samples

Top measurements by pChEMBL value

Data from ChEMBL 36 via Core Engine