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Compound Detail

CHEMBL10255

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COc1ccc(-c2cc(OC)c(OC)c(OC)c2)cc1O
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL10255
Phase Preclinical
Structure Type MOL
InChI Key LSUQJGASNCSRNF-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
2
Publications
0
Known Names

Molecular Properties

290.3
MW (Da)
3.09
ALogP
5
HBA
1
HBD
57.1
PSA (Ų)
0.92
QED
0
Ro5 Violations
5
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C16H18O5
MW 290.31
Aromatic Rings 2
Heavy Atoms 21
NP-Likeness 0.43

Literature References

PubMed DOI Target Context # Activities
1552500 10.1021/jm00084a011 Tubulin 4
11140732 10.1016/s0960-894x(00)00596-5 L1210 1

Data from ChEMBL 36 via Core Engine