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Compound Detail

CHEMBL1788326

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Cl.Nc1ncnc2nc(Br)[nH]c12
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1788326
Phase Preclinical
Structure Type MOL
InChI Key JUCRKYGUZGITLB-UHFFFAOYSA-N
Parent Compound CHEMBL65747
Active Moiety CHEMBL65747
0
Targets
2
Activities
2
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

214.0
MW (Da)
0.70
ALogP
4
HBA
2
HBD
80.5
PSA (Ų)
0.63
QED
0
Ro5 Violations
0
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C5H5BrClN5
MW 250.49
Aromatic Rings 2
Heavy Atoms 11
NP-Likeness -0.49

Activity Summary

IC50 1 meas.
Ki 1 meas.

Literature References

PubMed DOI Target Context # Activities
2165159 10.1021/jm00170a005 Phosphatidylinositol 4-kinase, PI4K 2

Data from ChEMBL 36 via Core Engine