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Compound Detail

CHEMBL4117036

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NCCCNCCCNCCC1CCCCCCCCCCCCCC1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL4117036
Phase Preclinical
Structure Type MOL
InChI Key MSPGFGUVJZWHOQ-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

367.7
MW (Da)
5.39
ALogP
3
HBA
3
HBD
50.1
PSA (Ų)
0.45
QED
1
Ro5 Violations
10
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C23H49N3
MW 367.67
Aromatic Rings 0
Heavy Atoms 26
NP-Likeness 0.02

Data from ChEMBL 36 via Core Engine