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Compound Detail

CHEMBL3752785

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COC(=O)c1cc(O)cc(O)c1C(=O)c1c(O)c(Cl)c(C)c(Cl)c1O
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL3752785
Phase Preclinical
Structure Type MOL
InChI Key SFJQFMIMZJIZHP-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

387.2
MW (Da)
3.14
ALogP
7
HBA
4
HBD
124.3
PSA (Ų)
0.47
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 C16H12Cl2O7
MW 387.17
Aromatic Rings 2
Heavy Atoms 25
NP-Likeness 0.89

Literature References

PubMed DOI Target Context # Activities
26706176 10.1016/j.bmcl.2015.12.009 Unchecked 1

Data from ChEMBL 36 via Core Engine