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

CHEMBL34182

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
COc1cc(C2CCC(OCCCn3c(C)nc4cnccc43)O2)cc(OC)c1OC

Basic Information

ChEMBL ID CHEMBL34182
Phase Preclinical
Structure Type MOL
InChI Key VMYSWDNNDBESMT-UHFFFAOYSA-N
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
2
Publications
0
Known Names

Molecular Properties

427.5
MW (Da)
4.05
ALogP
8
HBA
0
HBD
76.9
PSA (Ų)
0.48
QED
0
Ro5 Violations
9
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C23H29N3O5
MW 427.50
Aromatic Rings 3
Heavy Atoms 31
NP-Likeness -0.28

Activity Summary

IC50 1 meas. best 7.7

Target Activity Profile

Target Type Best pChEMBL Mean pChEMBL Best (nM) # Data
Platelet-activating factor receptor
CHEMBL250
IC50 7.7 7.7 20.0 1

Activity Data Samples

Top measurements by pChEMBL value

Literature References

PubMed DOI Target Context # Activities
- 10.1016/S0960-894X(00)80006-2 Platelet-activating factor receptor 1
- 10.1016/S0960-894X(00)80006-2 Rattus norvegicus 1

Data from ChEMBL 36 via Core Engine