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Compound Detail

CHEMBL175878

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CN(C)C(=O)c1ccc2[nH]c(-c3ccc(Oc4ccccc4)cc3)nc2c1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL175878
Phase Preclinical
Structure Type MOL
InChI Key WCRYXSBNKKJUIN-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

357.4
MW (Da)
4.72
ALogP
3
HBA
1
HBD
58.2
PSA (Ų)
0.57
QED
0
Ro5 Violations
4
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C22H19N3O2
MW 357.41
Aromatic Rings 4
Heavy Atoms 27
NP-Likeness -1.36

Literature References

PubMed DOI Target Context # Activities
15771432 10.1021/jm0495935 Serine/threonine-protein kinase Chk2 1

Data from ChEMBL 36 via Core Engine