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Compound Detail

CHEMBL3334555

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OCCn1cc(-c2cnc3nnn(Cc4cc5cccnc5[nH]4)c3n2)cn1

Basic Information

ChEMBL ID CHEMBL3334555
Phase Preclinical
Structure Type MOL
InChI Key ZXAZVWAHKQFAIL-UHFFFAOYSA-N
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

361.4
MW (Da)
1.00
ALogP
9
HBA
2
HBD
123.2
PSA (Ų)
0.48
QED
0
Ro5 Violations
5
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C17H15N9O
MW 361.37
Aromatic Rings 5
Heavy Atoms 27
NP-Likeness -1.82

Activity Summary

IC50 1 meas. best 6.64

Target Activity Profile

Target Type Best pChEMBL Mean pChEMBL Best (nM) # Data
Hepatocyte growth factor receptor
CHEMBL3717
IC50 6.64 6.64 227.0 1

Activity Data Samples

Top measurements by pChEMBL value

Literature References

PubMed DOI Target Context # Activities
25148209 10.1021/jm500510f Hepatocyte growth factor receptor 1

Data from ChEMBL 36 via Core Engine