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

CHEMBL1668001

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
CCCc1nc(C)n(CCO)c(=O)c1Cc1ccc(-c2ccccc2-c2nnn[nH]2)cc1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1668001
Phase Preclinical
Structure Type MOL
InChI Key ZRQUKQLJQGJURN-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

430.5
MW (Da)
2.93
ALogP
7
HBA
2
HBD
109.6
PSA (Ų)
0.44
QED
0
Ro5 Violations
8
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C24H26N6O2
MW 430.51
Aromatic Rings 4
Heavy Atoms 32
NP-Likeness -1.03

Literature References

PubMed DOI Target Context # Activities
21071232 10.1016/j.bmc.2010.10.043 Unchecked 1

Data from ChEMBL 36 via Core Engine