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

CHEMBL5633769

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(CN(CCCCc2ccccc2)C(=O)N[C@@H](C)C(=O)O)cc(OC)c1C
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL5633769
Phase Preclinical
Structure Type MOL
InChI Key ZQEFQZHUQRMRND-SFHVURJKSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

428.5
MW (Da)
4.02
ALogP
4
HBA
2
HBD
88.1
PSA (Ų)
0.53
QED
0
Ro5 Violations
11
Rot. Bonds

Drug Information

Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C24H32N2O5
MW 428.53
Aromatic Rings 2
Heavy Atoms 31
NP-Likeness -0.58

Literature References

PubMed DOI Target Context # Activities
37639822 10.1016/j.ejmech.2023.115749 Lysophosphatidic acid receptor 1 1

Data from ChEMBL 36 via Core Engine