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

CHEMBL4634720

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[C@H]1OC(=O)c2c(O)cc(O)c(Cl)c2/C=C/CC/C=C/[C@@H]1O
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL4634720
Phase Preclinical
Structure Type MOL
InChI Key KQXVIOVDPLNPLZ-MJUWSYLBSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
5
Publications
0
Known Names

Molecular Properties

324.8
MW (Da)
3.02
ALogP
5
HBA
3
HBD
87.0
PSA (Ų)
0.50
QED
0
Ro5 Violations
0
Rot. Bonds

Drug Information

Molecule Type Unknown
Availability Unknown
Chirality Unknown

Flags

Natural Product First in Class Prodrug

Extended Properties

Molecular Formula C16H17ClO5
MW 324.76
Aromatic Rings 1
Heavy Atoms 22
NP-Likeness 1.96

Literature References

PubMed DOI Target Context # Activities
32323537 10.1021/acs.jnatprod.9b01167 A549 1
32323537 10.1021/acs.jnatprod.9b01167 769-P 1
32323537 10.1021/acs.jnatprod.9b01167 HCT-116 1
32323537 10.1021/acs.jnatprod.9b01167 T-cell 1
32323537 10.1021/acs.jnatprod.9b01167 B-cell line 1

Data from ChEMBL 36 via Core Engine