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Compound Detail

CHEMBL1825140

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Nc1ncc(-c2ccc(OCCN3CCOCC3)cc2)cc1OCc1c(Cl)cccc1Cl

Basic Information

ChEMBL ID CHEMBL1825140
Phase Preclinical
Structure Type MOL
InChI Key SWSODYAMDICARQ-UHFFFAOYSA-N
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

474.4
MW (Da)
4.93
ALogP
6
HBA
1
HBD
69.8
PSA (Ų)
0.50
QED
0
Ro5 Violations
8
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C24H25Cl2N3O3
MW 474.39
Aromatic Rings 3
Heavy Atoms 32
NP-Likeness -1.20

Activity Summary

Ki 1 meas. best 5.61

Target Activity Profile

Target Type Best pChEMBL Mean pChEMBL Best (nM) # Data
Hepatocyte growth factor receptor
CHEMBL3717
Ki 5.61 5.61 2450.0 1

Activity Data Samples

Top measurements by pChEMBL value

Literature References

PubMed DOI Target Context # Activities
21812414 10.1021/jm2007613 Hepatocyte growth factor receptor 1

Data from ChEMBL 36 via Core Engine