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Compound Detail

CHEMBL3692694

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COc1ccc(C2=[N+]3C(=C(CCCCc4cn(C[C@@H]5[C@@H](O)[C@H](O)[C@@H](O)[C@@H]6O[C@H]56)nn4)c4ccc(-c5ccc(OC)cc5)n4[B-]3(F)F)C=C2)cc1

Basic Information

ChEMBL ID CHEMBL3692694
Phase Preclinical
Structure Type MOL
InChI Key OWVDUFOFLDIMAR-SVBJHREWSA-N
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

685.5
MW (Da)

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C36H38BF2N5O6
MW 685.54

Activity Summary

Ki 1 meas. best 8.81

Target Activity Profile

Target Type Best pChEMBL Mean pChEMBL Best (nM) # Data
Lysosomal acid glucosylceramidase
CHEMBL2179
Ki 8.81 8.81 1.6 1

Activity Data Samples

Top measurements by pChEMBL value

Data from ChEMBL 36 via Core Engine