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

CHEMBL608893

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
Nc1ncnc2c1ncn2C1O[C@H](C(=O)NC2CCCCCCC2)[C@@H](O)[C@H]1O

Basic Information

ChEMBL ID CHEMBL608893
Phase Preclinical
Structure Type MOL
InChI Key ZIHYGOOJSWDFKE-CDJKEZFESA-N
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

390.4
MW (Da)
0.26
ALogP
9
HBA
4
HBD
148.4
PSA (Ų)
0.58
QED
0
Ro5 Violations
3
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C18H26N6O4
MW 390.44
Aromatic Rings 2
Heavy Atoms 28
NP-Likeness 0.34

Activity Summary

Ki 1 meas. best 7.64

Target Activity Profile

Target Type Best pChEMBL Mean pChEMBL Best (nM) # Data
2-oxoglutarate receptor 1
CHEMBL2325
Ki 7.64 7.64 23.0 1

Activity Data Samples

Top measurements by pChEMBL value

Literature References

PubMed DOI Target Context # Activities
11170630 10.1021/jm000150k 2-oxoglutarate receptor 1 1

Data from ChEMBL 36 via Core Engine