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Compound Detail

CHEMBL5204967

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CCn1cc(Nc2ncc3cccc(-c4ccc(OC)cc4)c3n2)cn1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL5204967
Phase Preclinical
Structure Type MOL
InChI Key TWEPWCUIQKRSBO-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

345.4
MW (Da)
4.27
ALogP
6
HBA
1
HBD
64.9
PSA (Ų)
0.59
QED
0
Ro5 Violations
5
Rot. Bonds

Drug Information

Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C20H19N5O
MW 345.41
Aromatic Rings 4
Heavy Atoms 26
NP-Likeness -1.52

Literature References

PubMed DOI Target Context # Activities
36127295 10.1021/acs.jmedchem.2c00736 eIF-2-alpha kinase GCN2 1

Data from ChEMBL 36 via Core Engine