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Compound Detail

CHEMBL1160579

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OCC1CCCC(NCc2ccccc2)=N1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1160579
Phase Preclinical
Structure Type MOL
InChI Key DGEZPPFAWZEIJP-UHFFFAOYSA-N
0
Targets
2
Activities
1
Assay Types
0
PK Parameters
2
Publications
0
Known Names

Molecular Properties

218.3
MW (Da)
1.72
ALogP
3
HBA
2
HBD
44.6
PSA (Ų)
0.81
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 C13H18N2O
MW 218.30
Aromatic Rings 1
Heavy Atoms 16
NP-Likeness -0.10

Activity Summary

Ki 2 meas.

Literature References

PubMed DOI Target Context # Activities
- 10.1016/0960-894X(95)00474-8 Unchecked 1
- 10.1016/0960-894X(95)00474-8 Lysosomal alpha-glucosidase 1

Data from ChEMBL 36 via Core Engine