Skip to main content
Free research Free research Free compound review with research home and workspace preview
Quick search ChEMBL 36
Compound Detail

CHEMBL202925

Enter ChEMBL ID:
Free Research Context This compound will appear in recent viewed items on the research home for this browser.
Research home View demo workspace
CCCn1c(=O)c2nc(-c3ccc(OCC(=O)c4ccc(C(=O)OCC)cc4)nn3)[nH]c2n(CCC)c1=O
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL202925
Phase Preclinical
Structure Type MOL
InChI Key QSJLXZWSNFMWSF-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
7
Publications
0
Known Names

Molecular Properties

520.5
MW (Da)
2.60
ALogP
11
HBA
1
HBD
151.1
PSA (Ų)
0.23
QED
2
Ro5 Violations
11
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C26H28N6O6
MW 520.55
Aromatic Rings 4
Heavy Atoms 38
NP-Likeness -1.15

Literature References

PubMed DOI Target Context # Activities
16392813 10.1021/jm0506221 Adenosine receptor A2b 5
16392813 10.1021/jm0506221 Adenosine receptor A2a 5
16392813 10.1021/jm0506221 Adenosine receptor A1 2
16392813 10.1021/jm0506221 Adenosine receptor A3 2
16392813 10.1021/jm0506221 Adenosine A2 receptor 1
16392813 10.1021/jm0506221 Adenosine receptors; A2b & A3 1
16392813 10.1021/jm0506221 Adenosine receptors; A1 & A2b 1

Data from ChEMBL 36 via Core Engine