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Compound Detail

CHEMBL1224554

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OCc1ccc(Cl)cc1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1224554
Phase Preclinical
Structure Type MOL
InChI Key PTHGDVCPCZKZKR-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

142.6
MW (Da)
1.83
ALogP
1
HBA
1
HBD
20.2
PSA (Ų)
0.63
QED
0
Ro5 Violations
1
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C7H7ClO
MW 142.58
Aromatic Rings 1
Heavy Atoms 9
NP-Likeness -0.33

Literature References

PubMed DOI Target Context # Activities
20688518 10.1016/j.bmcl.2010.07.025 Indoleamine 2,3-dioxygenase 1 2

Data from ChEMBL 36 via Core Engine