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Compound Detail

CHEMBL3952184

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Brc1cnc(Nc2ccccc2)nc1Nc1ccccc1

Basic Information

ChEMBL ID CHEMBL3952184
Phase Preclinical
Structure Type MOL
InChI Key XIXDCPLPNMFZSX-UHFFFAOYSA-N
1
Targets
2
Activities
1
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

341.2
MW (Da)
4.73
ALogP
4
HBA
2
HBD
49.8
PSA (Ų)
0.72
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 C16H13BrN4
MW 341.21
Aromatic Rings 3
Heavy Atoms 21
NP-Likeness -1.02

Activity Summary

IC50 2 meas. best 7.3

Target Activity Profile

Target Type Best pChEMBL Mean pChEMBL Best (nM) # Data
Insulin-like growth factor 1 receptor
CHEMBL1957
IC50 7.3 6.8 50.0 2

Activity Data Samples

Top measurements by pChEMBL value

Data from ChEMBL 36 via Core Engine