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Compound Detail

CHEMBL3309266

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O=C(N1CCOCC1)N1CCc2c([nH]c3ccccc23)C1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL3309266
Phase Preclinical
Structure Type MOL
InChI Key KNRNYLMTKZGLCH-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
3
Publications
0
Known Names

Molecular Properties

285.4
MW (Da)
1.98
ALogP
2
HBA
1
HBD
48.6
PSA (Ų)
0.80
QED
0
Ro5 Violations
0
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C16H19N3O2
MW 285.35
Aromatic Rings 2
Heavy Atoms 21
NP-Likeness -0.96

Literature References

PubMed DOI Target Context # Activities
24980054 10.1016/j.bmcl.2014.06.030 Leishmania donovani 6
24980054 10.1016/j.bmcl.2014.06.030 Trypanosoma brucei 2
26560048 10.1016/j.ejmech.2015.10.049 Unchecked 1

Data from ChEMBL 36 via Core Engine