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Compound Detail

CHEMBL480529

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Cc1cn2c(nc3c2c(=O)n(C)c(=O)n3C)[nH]1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL480529
Phase Preclinical
Structure Type MOL
InChI Key UCRWKJWWUYKFAC-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
4
Publications
0
Known Names

Molecular Properties

233.2
MW (Da)
-0.48
ALogP
6
HBA
1
HBD
77.1
PSA (Ų)
0.57
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 C10H11N5O2
MW 233.23
Aromatic Rings 3
Heavy Atoms 17
NP-Likeness -1.24

Literature References

PubMed DOI Target Context # Activities
19006671 10.1016/j.bmc.2008.10.049 Adenosine receptor A1 1
19006671 10.1016/j.bmc.2008.10.049 Adenosine receptor A2a 1
19006671 10.1016/j.bmc.2008.10.049 Adenosine receptor A2b 1
19006671 10.1016/j.bmc.2008.10.049 Adenosine receptor A3 1

Data from ChEMBL 36 via Core Engine