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Compound Detail

CHEMBL1096379

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C[N+](C)(C)CCCCCCC[N+](C)(C)C.[Br-].[Br-]
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1096379
Phase Preclinical
Structure Type MOL
InChI Key VFBNKSCGJOBFNU-UHFFFAOYSA-L
Parent Compound CHEMBL1199113
Active Moiety CHEMBL1199113
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
2
Publications
0
Known Names

Molecular Properties

216.4
MW (Da)
2.35
ALogP
0
HBA
0
HBD
0.0
PSA (Ų)
0.43
QED
0
Ro5 Violations
8
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C13H32Br2N2
MW 376.22
Aromatic Rings 0
Heavy Atoms 15
NP-Likeness 0.53

Literature References

PubMed DOI Target Context # Activities
20382538 10.1016/j.bmc.2010.03.067 Plasmodium falciparum 1
20382538 10.1016/j.bmc.2010.03.067 ADMET 1

Data from ChEMBL 36 via Core Engine