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Compound Detail

CHEMBL4586192

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O=C(NCc1cccc(Cl)c1)c1cc(Cl)ccc1O
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL4586192
Phase Preclinical
Structure Type MOL
InChI Key DFFBUAAGAVUEBG-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
3
Publications
0
Known Names

Molecular Properties

296.1
MW (Da)
3.63
ALogP
2
HBA
2
HBD
49.3
PSA (Ų)
0.91
QED
0
Ro5 Violations
3
Rot. Bonds

Drug Information

Molecule Type Unknown
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C14H11Cl2NO2
MW 296.15
Aromatic Rings 2
Heavy Atoms 19
NP-Likeness -1.41

Literature References

PubMed DOI Target Context # Activities
32045239 10.1021/acs.jmedchem.9b01950 Human adenovirus 5 2
32045239 10.1021/acs.jmedchem.9b01950 A549 1
32045239 10.1021/acs.jmedchem.9b01950 Unchecked 1

Data from ChEMBL 36 via Core Engine