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Compound Detail

CHEMBL5940985

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COc1ccccc1S(=O)(=O)Nc1noc2cc(Cn3cccn3)c(F)c(OC)c12

Basic Information

ChEMBL ID CHEMBL5940985
Phase Preclinical
Structure Type MOL
InChI Key VKSUDFPRHJVUDB-UHFFFAOYSA-N
2
Targets
2
Activities
1
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

432.4
MW (Da)
3.03
ALogP
8
HBA
1
HBD
108.5
PSA (Ų)
0.48
QED
0
Ro5 Violations
7
Rot. Bonds

Drug Information

Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C19H17FN4O5S
MW 432.43
Aromatic Rings 4
Heavy Atoms 30
NP-Likeness -1.86

Activity Summary

Ki 2 meas. best 9.48

Target Activity Profile

Target Type Best pChEMBL Mean pChEMBL Best (nM) # Data
Histone acetyltransferase KAT6A
CHEMBL3774298
Ki 9.48 9.48 0.3 1
Histone acetyltransferase KAT7
CHEMBL3774299
Ki 7.97 7.97 10.6 1

Activity Data Samples

Top measurements by pChEMBL value

Data from ChEMBL 36 via Core Engine