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

CHEMBL261315

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
C=C[C@@](C)(/C=C/c1ccc(O)cc1)CCC(O)C(C)(C)O
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL261315
Phase Preclinical
Structure Type MOL
InChI Key QIXGHNLALDUHDP-AVNQGEAYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
12
Publications
0
Known Names

Molecular Properties

290.4
MW (Da)
3.51
ALogP
3
HBA
3
HBD
60.7
PSA (Ų)
0.67
QED
0
Ro5 Violations
7
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

Natural Product First in Class Prodrug

Extended Properties

Molecular Formula C18H26O3
MW 290.40
Aromatic Rings 1
Heavy Atoms 21
NP-Likeness 1.78

Literature References

PubMed DOI Target Context # Activities
18063371 10.1016/j.bmc.2007.11.054 NON-PROTEIN TARGET 6
18063371 10.1016/j.bmc.2007.11.054 ADMET 3
26922230 10.1016/j.ejmech.2016.02.034 NON-PROTEIN TARGET 2
18359631 10.1016/j.bmcl.2008.03.028 Hypoxia inducible factors; HIF-1-alpha, HIF-2-alpha 1
18359631 10.1016/j.bmcl.2008.03.028 AGS 1
18359631 10.1016/j.bmcl.2008.03.028 Unchecked 1
18359631 10.1016/j.bmcl.2008.03.028 HeLa 1
26922230 10.1016/j.ejmech.2016.02.034 HepG2 1
26922230 10.1016/j.ejmech.2016.02.034 Raji 1
26922230 10.1016/j.ejmech.2016.02.034 Jurkat 1
26922230 10.1016/j.ejmech.2016.02.034 BJ 1
26922230 10.1016/j.ejmech.2016.02.034 HEK293 1

Data from ChEMBL 36 via Core Engine