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Compound Detail

CHEMBL1591893

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c1ccc(Nc2nc(-c3cccnc3)nc3ccccc23)cc1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1591893
Phase Preclinical
Structure Type MOL
InChI Key RWCJXYFRNMIQLP-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

298.4
MW (Da)
4.44
ALogP
4
HBA
1
HBD
50.7
PSA (Ų)
0.61
QED
0
Ro5 Violations
3
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C19H14N4
MW 298.35
Aromatic Rings 4
Heavy Atoms 23
NP-Likeness -1.58

Literature References

PubMed DOI Target Context # Activities
27598312 10.1021/acs.jmedchem.6b00930 Lysosomal acid glucosylceramidase 2

Data from ChEMBL 36 via Core Engine