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Compound Detail

CHEMBL4632573

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CN(c1cc(NC2CC2)ncn1)C1CCCCC1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL4632573
Phase Preclinical
Structure Type MOL
InChI Key WAGOMLNFCQIYAM-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
2
Publications
0
Known Names

Molecular Properties

246.4
MW (Da)
2.82
ALogP
4
HBA
1
HBD
41.0
PSA (Ų)
0.89
QED
0
Ro5 Violations
4
Rot. Bonds

Drug Information

Molecule Type Unknown
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C14H22N4
MW 246.36
Aromatic Rings 1
Heavy Atoms 18
NP-Likeness -1.36

Literature References

PubMed DOI Target Context # Activities
32511913 10.1021/acs.jmedchem.0c00450 Tyrosine-protein kinase JAK3 1
32511913 10.1021/acs.jmedchem.0c00450 Tyrosine-protein kinase Lck 1

Data from ChEMBL 36 via Core Engine