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

CHEMBL5405447

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=C1[C@@H](C)[C@H]2[C@H](Cc3ccccc3)NC(=O)[C@@]2(C(=O)OC)[C@@H](CCOCCc2ccccc2)[C@@H]1O
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL5405447
Phase Preclinical
Structure Type MOL
InChI Key SXINOOQKRIYUSN-WZPPLUGOSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
3
Publications
0
Known Names

Molecular Properties

477.6
MW (Da)
3.34
ALogP
5
HBA
2
HBD
84.9
PSA (Ų)
0.25
QED
0
Ro5 Violations
9
Rot. Bonds

Drug Information

Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C29H35NO5
MW 477.60
Aromatic Rings 2
Heavy Atoms 35
NP-Likeness 1.24

Literature References

PubMed DOI Target Context # Activities
38283219 10.1039/d3md00535f Unchecked 5
38283219 10.1039/d3md00535f HT-1080 1
38283219 10.1039/d3md00535f MRC5 1

Data from ChEMBL 36 via Core Engine