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Compound Detail

CHEMBL30259

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CCCC1C(=O)N(C)C2N(C)C=NN2C1=O
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL30259
Phase Preclinical
Structure Type MOL
InChI Key CEEYUARWHNPXSD-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
2
Publications
0
Known Names

Molecular Properties

224.3
MW (Da)
-0.12
ALogP
4
HBA
0
HBD
56.2
PSA (Ų)
0.61
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 C10H16N4O2
MW 224.26
Aromatic Rings 0
Heavy Atoms 16
NP-Likeness 0.17

Literature References

PubMed DOI Target Context # Activities
6090665 10.1021/jm00376a027 Adenosine receptor A1 1
6090665 10.1021/jm00376a027 Cavia porcellus 1

Data from ChEMBL 36 via Core Engine