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Compound Detail

CHEMBL4175125

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Cl.NNc1ccc(F)cc1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL4175125
Phase Preclinical
Structure Type MOL
InChI Key FEKUXLUOKFSMRO-UHFFFAOYSA-N
Parent Compound CHEMBL3884307
Active Moiety CHEMBL3884307
0
Targets
1
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

126.1
MW (Da)
1.11
ALogP
2
HBA
2
HBD
38.0
PSA (Ų)
0.44
QED
0
Ro5 Violations
1
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C6H8ClFN2
MW 162.59
Aromatic Rings 1
Heavy Atoms 9
NP-Likeness -1.91

Activity Summary

IC50 1 meas.

Literature References

PubMed DOI Target Context # Activities
28527406 10.1016/j.ejmech.2017.05.015 Histone acetyltransferase KAT8 2

Data from ChEMBL 36 via Core Engine