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Compound Detail

CHEMBL266255

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O=C1NC(=O)c2cc3c(cc21)N(c1ccccc1)CCN3c1ccccc1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL266255
Phase Preclinical
Structure Type MOL
InChI Key DNRPTTQOSZQOGJ-UHFFFAOYSA-N
0
Targets
1
Activities
1
Assay Types
0
PK Parameters
5
Publications
0
Known Names

Molecular Properties

355.4
MW (Da)
3.86
ALogP
4
HBA
1
HBD
52.6
PSA (Ų)
0.71
QED
0
Ro5 Violations
2
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C22H17N3O2
MW 355.40
Aromatic Rings 3
Heavy Atoms 27
NP-Likeness -0.55

Activity Summary

IC50 1 meas.

Literature References

PubMed DOI Target Context # Activities
8151612 10.1021/jm00033a019 Epidermal growth factor receptor 1
8151612 10.1021/jm00033a019 Tyrosine-protein kinase ABL 1
8151612 10.1021/jm00033a019 Proto-oncogene tyrosine-protein kinase Src 1
8151612 10.1021/jm00033a019 Protein kinase C (PKC) 1
8151612 10.1021/jm00033a019 cAMP-dependent protein kinase alpha-catalytic subunit 1

Data from ChEMBL 36 via Core Engine