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Compound Detail

CHEMBL59482

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Clc1ccc(/N=c2\ccn(Cc3ccccc3Cl)c3cc(Cl)ccc23)c(Cl)c1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL59482
Phase Preclinical
Structure Type MOL
InChI Key PAKNNKHWZPSIOR-NHFJDJAPSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
2
Publications
0
Known Names

Molecular Properties

448.2
MW (Da)
7.54
ALogP
2
HBA
0
HBD
17.3
PSA (Ų)
0.31
QED
1
Ro5 Violations
3
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C22H14Cl4N2
MW 448.18
Aromatic Rings 4
Heavy Atoms 28
NP-Likeness -1.33

Literature References

PubMed DOI Target Context # Activities
7540207 10.1021/jm00011a007 Potassium voltage-gated channel subfamily A member 3 2
7540207 10.1021/jm00011a007 Unchecked 1

Data from ChEMBL 36 via Core Engine