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

CHEMBL2321897

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
COC(=O)c1ccc2c3c(n(CCCN)c(=O)c2c1)-c1ccccc1C3=O.Cl
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL2321897
Phase Preclinical
Structure Type MOL
InChI Key UHIWYUQDOGXACK-UHFFFAOYSA-N
Parent Compound CHEMBL2365203
Active Moiety CHEMBL2365203
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
2
Publications
0
Known Names

Molecular Properties

362.4
MW (Da)
2.35
ALogP
6
HBA
1
HBD
91.4
PSA (Ų)
0.56
QED
0
Ro5 Violations
4
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C21H19ClN2O4
MW 398.85
Aromatic Rings 3
Heavy Atoms 27
NP-Likeness 0.12

Literature References

PubMed DOI Target Context # Activities
23472886 10.1021/jm400026k Retinoic acid receptor RXR-alpha 3
23472886 10.1021/jm400026k COS-1 1

Data from ChEMBL 36 via Core Engine