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Compound Detail

CHEMBL324266

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O=C(Nc1ccccc1Oc1ccc(C(=O)O)c(C(=O)O)c1)c1ccc(Cl)c(Cl)c1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL324266
Phase Preclinical
Structure Type MOL
InChI Key IQXFKBFMLORBCB-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

446.2
MW (Da)
5.43
ALogP
4
HBA
3
HBD
112.9
PSA (Ų)
0.47
QED
1
Ro5 Violations
6
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C21H13Cl2NO6
MW 446.24
Aromatic Rings 3
Heavy Atoms 30
NP-Likeness -1.19

Literature References

PubMed DOI Target Context # Activities
15214781 10.1021/jm031121n Glycogen phosphorylase, liver form 1

Data from ChEMBL 36 via Core Engine