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Compound Detail

CHEMBL464460

CORYLIN
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CC(C)=CCc1cc(-c2coc3cc(O)cc(O)c3c2=O)ccc1O
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL464460
Name CORYLIN
Phase Preclinical
Structure Type MOL
InChI Key SWDSVBNAMCDHTF-UHFFFAOYSA-N
0
Targets
1
Activities
1
Assay Types
0
PK Parameters
10
Publications
0
Known Names

Molecular Properties

338.4
MW (Da)
4.09
ALogP
5
HBA
3
HBD
90.9
PSA (Ų)
0.63
QED
0
Ro5 Violations
3
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

Natural Product First in Class Prodrug

Extended Properties

Molecular Formula C20H18O5
MW 338.36
Aromatic Rings 3
Heavy Atoms 25
NP-Likeness 1.89

Activity Summary

IC50 1 meas.

Literature References

PubMed DOI Target Context # Activities
20934335 10.1016/j.bmcl.2010.09.077 Neuraminidase 3
19705860 10.1021/np900271m Estrogen receptor 1
19705860 10.1021/np900271m Estrogen receptor beta 1
19705860 10.1021/np900271m Unchecked 1
25710081 10.1021/np500834d Unchecked 1
25710081 10.1021/np500834d K562 1
25710081 10.1021/np500834d A549 1
25710081 10.1021/np500834d NAD-dependent protein deacetylase sirtuin-1 1
32196343 10.1021/acs.jnatprod.9b00262 Unchecked 1
33170684 10.1021/acs.jnatprod.0c00932 Listeria monocytogenes 1

Data from ChEMBL 36 via Core Engine