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

CHEMBL3601092

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
O=C(NCC1CCCCC1)c1ccc(NC(=O)c2cccc(CN3C(=O)OC[C@H]3Cc3ccccc3)c2)cc1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL3601092
Phase Preclinical
Structure Type MOL
InChI Key ZUPZVOKXJYNBAD-GDLZYMKVSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
2
Publications
0
Known Names

Molecular Properties

525.6
MW (Da)
5.81
ALogP
4
HBA
2
HBD
87.7
PSA (Ų)
0.37
QED
2
Ro5 Violations
9
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C32H35N3O4
MW 525.65
Aromatic Rings 3
Heavy Atoms 39
NP-Likeness -0.97

Literature References

PubMed DOI Target Context # Activities
26226490 10.1021/acs.jmedchem.5b00849 Peroxisome proliferator-activated receptor gamma 1
26226490 10.1021/acs.jmedchem.5b00849 Peroxisome proliferator-activated receptor alpha 1

Data from ChEMBL 36 via Core Engine