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Compound Detail

CHEMBL30566

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CNc1nc(-c2ccc(N(C)C)cc2)cc2ncccc12

Basic Information

ChEMBL ID CHEMBL30566
Phase Preclinical
Structure Type MOL
InChI Key BREWRMYGMSBIMN-UHFFFAOYSA-N
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

278.4
MW (Da)
3.40
ALogP
4
HBA
1
HBD
41.0
PSA (Ų)
0.80
QED
0
Ro5 Violations
3
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C17H18N4
MW 278.36
Aromatic Rings 3
Heavy Atoms 21
NP-Likeness -1.22

Activity Summary

IC50 1 meas. best 6.64

Target Activity Profile

Target Type Best pChEMBL Mean pChEMBL Best (nM) # Data
Tyrosine-protein kinase SYK
CHEMBL2599
IC50 6.64 6.64 230.0 1

Activity Data Samples

Top measurements by pChEMBL value

Target Type Rel. Value Units pChEMBL Assay PubMed
Tyrosine-protein kinase SYK IC50 = 230.0 nM 6.64 Inhibitory activity against spleen tyrosine kinase (SYK) 12668002

Literature References

PubMed DOI Target Context # Activities
12668002 10.1016/s0960-894x(03)00163-x Tyrosine-protein kinase SYK 1

Data from ChEMBL 36 via Core Engine