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Compound Detail

CHEMBL6043937

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Oc1ccc(NCc2ccc(Br)cc2)cc1

Basic Information

ChEMBL ID CHEMBL6043937
Phase Preclinical
Structure Type MOL
InChI Key ILJGLDKNRMBPNI-UHFFFAOYSA-N
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

278.1
MW (Da)
3.77
ALogP
2
HBA
2
HBD
32.3
PSA (Ų)
0.84
QED
0
Ro5 Violations
3
Rot. Bonds

Drug Information

Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C13H12BrNO
MW 278.15
Aromatic Rings 2
Heavy Atoms 16
NP-Likeness -0.71

Activity Summary

Kd 1 meas. best 8.85

Target Activity Profile

Target Type Best pChEMBL Mean pChEMBL Best (nM) # Data
Advanced glycosylation end product-specific receptor
CHEMBL2176846
Kd 8.85 8.85 1.4 1

Activity Data Samples

Top measurements by pChEMBL value

Data from ChEMBL 36 via Core Engine