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Compound Detail

CHEMBL3403754

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Cc1cc(=O)n(C)cc1-c1cnc2[nH]c(-c3c(F)cccc3Cl)cc2c1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL3403754
Phase Preclinical
Structure Type MOL
InChI Key CQBLZTCCUSPBGM-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

367.8
MW (Da)
4.70
ALogP
3
HBA
1
HBD
50.7
PSA (Ų)
0.56
QED
0
Ro5 Violations
2
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C20H15ClFN3O
MW 367.81
Aromatic Rings 4
Heavy Atoms 26
NP-Likeness -1.11

Literature References

PubMed DOI Target Context # Activities
25690784 10.1016/j.bmcl.2015.01.063 Unchecked 2

Data from ChEMBL 36 via Core Engine