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Compound Detail

CHEMBL3674534

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CC(N=N)c1cnc2nnn(Cc3ccc4ncccc4c3)c2n1

Basic Information

ChEMBL ID CHEMBL3674534
Phase Preclinical
Structure Type MOL
InChI Key CPJBMGRCRXWCCI-UHFFFAOYSA-N
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

318.3
MW (Da)
2.91
ALogP
8
HBA
1
HBD
105.6
PSA (Ų)
0.58
QED
0
Ro5 Violations
4
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C16H14N8
MW 318.34
Aromatic Rings 4
Heavy Atoms 24
NP-Likeness -1.49

Activity Summary

IC50 1 meas. best 8.3

Target Activity Profile

Target Type Best pChEMBL Mean pChEMBL Best (nM) # Data
Hepatocyte growth factor receptor
CHEMBL3717
IC50 8.3 8.3 5.0 1

Activity Data Samples

Top measurements by pChEMBL value

Data from ChEMBL 36 via Core Engine