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Compound Detail

CHEMBL190144

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Cc1ccc(-c2cc3c(N)ncnc3nc2-c2cc3ccccc3o2)cc1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL190144
Phase Preclinical
Structure Type MOL
InChI Key BTSWCBHWUYKIKO-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

352.4
MW (Da)
5.00
ALogP
5
HBA
1
HBD
77.8
PSA (Ų)
0.48
QED
0
Ro5 Violations
2
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C22H16N4O
MW 352.40
Aromatic Rings 5
Heavy Atoms 27
NP-Likeness -0.29

Literature References

PubMed DOI Target Context # Activities
15911258 10.1016/j.bmcl.2005.03.098 Adenosine kinase 2

Data from ChEMBL 36 via Core Engine