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Compound Detail

CHEMBL1181134

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NCCCNCCCCNCCCNc1ccccc1

Basic Information

ChEMBL ID CHEMBL1181134
Phase Preclinical
Structure Type MOL
InChI Key MNRDWOXIXFUWNV-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

278.4
MW (Da)
1.80
ALogP
4
HBA
4
HBD
62.1
PSA (Ų)
0.42
QED
0
Ro5 Violations
13
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C16H30N4
MW 278.44
Aromatic Rings 1
Heavy Atoms 20
NP-Likeness -0.42

Data from ChEMBL 36 via Core Engine