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Compound Detail

CHEMBL3263567

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O=C1/C(=C/c2ccc(CO)o2)Oc2cc(O)cc(O)c21
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL3263567
Phase Preclinical
Structure Type MOL
InChI Key MHAIPJJDTKFAPN-XGICHPGQSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

274.2
MW (Da)
1.80
ALogP
6
HBA
3
HBD
100.1
PSA (Ų)
0.72
QED
0
Ro5 Violations
2
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C14H10O6
MW 274.23
Aromatic Rings 2
Heavy Atoms 20
NP-Likeness 0.74

Literature References

PubMed DOI Target Context # Activities
24835816 10.1016/j.ejmech.2014.04.005 Unchecked 2

Data from ChEMBL 36 via Core Engine