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Compound Detail

CHEMBL406346

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O=C(NCc1c(F)cccc1Cl)c1cccn1Cc1ccccc1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL406346
Phase Preclinical
Structure Type MOL
InChI Key QDGLLBPKLZJNGT-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

342.8
MW (Da)
4.26
ALogP
2
HBA
1
HBD
34.0
PSA (Ų)
0.74
QED
0
Ro5 Violations
5
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C19H16ClFN2O
MW 342.80
Aromatic Rings 3
Heavy Atoms 24
NP-Likeness -1.94

Literature References

PubMed DOI Target Context # Activities
18467094 10.1016/j.bmcl.2008.04.048 Jurkat 1

Data from ChEMBL 36 via Core Engine