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Compound Detail

CHEMBL5569641

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O=C1COc2cc(-c3ccc4nnc(Cc5ccc6ncccc6c5)n4n3)ccc2N1

Basic Information

ChEMBL ID CHEMBL5569641
Phase Preclinical
Structure Type MOL
InChI Key QDZZKLFMPSOGBT-UHFFFAOYSA-N
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

408.4
MW (Da)
3.26
ALogP
7
HBA
1
HBD
94.3
PSA (Ų)
0.49
QED
0
Ro5 Violations
3
Rot. Bonds

Drug Information

Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C23H16N6O2
MW 408.42
Aromatic Rings 5
Heavy Atoms 31
NP-Likeness -1.77

Activity Summary

IC50 1 meas. best 7.58

Target Activity Profile

Target Type Best pChEMBL Mean pChEMBL Best (nM) # Data
Hepatocyte growth factor receptor
CHEMBL3717
IC50 7.58 7.58 26.2 1

Activity Data Samples

Top measurements by pChEMBL value

Literature References

PubMed DOI Target Context # Activities
38086189 10.1016/j.ejmech.2023.116025 Hepatocyte growth factor receptor 1

Data from ChEMBL 36 via Core Engine