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Compound Detail

CHEMBL5595643

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Cn1ccc2cc3ccncc3cc21
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL5595643
Phase Preclinical
Structure Type MOL
InChI Key YSUXPXRNMWYLEU-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
8
Publications
0
Known Names

Molecular Properties

182.2
MW (Da)
2.73
ALogP
2
HBA
0
HBD
17.8
PSA (Ų)
0.52
QED
0
Ro5 Violations
0
Rot. Bonds

Drug Information

Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C12H10N2
MW 182.23
Aromatic Rings 3
Heavy Atoms 14
NP-Likeness -0.78

Literature References

PubMed DOI Target Context # Activities
38320389 10.1016/j.bmc.2024.117619 Serine/threonine-protein kinase haspin 3
38320389 10.1016/j.bmc.2024.117619 Dual specificity protein kinase CLK1 2
38320389 10.1016/j.bmc.2024.117619 Dual specificity tyrosine-phosphorylation-regulated kinase 1A 2
38320389 10.1016/j.bmc.2024.117619 CDK9/cyclin T1 2
38320389 10.1016/j.bmc.2024.117619 Glycogen synthase kinase-3 beta 2
38320389 10.1016/j.bmc.2024.117619 Casein kinase I isoform epsilon 2
38320389 10.1016/j.bmc.2024.117619 Cyclin-dependent kinase 5/CDK5 activator 1 2
38320389 10.1016/j.bmc.2024.117619 Serine/threonine-protein kinase pim-1 2

Data from ChEMBL 36 via Core Engine