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Compound Detail

CHEMBL1616040

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CCCCCOc1ccc(CN2CCOCC2)cc1Cl
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1616040
Phase Preclinical
Structure Type MOL
InChI Key JQGJGTZXBCSRMG-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

297.8
MW (Da)
3.74
ALogP
3
HBA
0
HBD
21.7
PSA (Ų)
0.72
QED
0
Ro5 Violations
7
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C16H24ClNO2
MW 297.83
Aromatic Rings 1
Heavy Atoms 20
NP-Likeness -1.48

Data from ChEMBL 36 via Core Engine