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Compound Detail

CHEMBL329087

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CCC(CC)N1CCN(C(=O)CCOc2ccc(Cl)cc2)CC1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL329087
Phase Preclinical
Structure Type MOL
InChI Key YJFDIOUKLJAALV-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

338.9
MW (Da)
3.44
ALogP
3
HBA
0
HBD
32.8
PSA (Ų)
0.76
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 C18H27ClN2O2
MW 338.88
Aromatic Rings 1
Heavy Atoms 23
NP-Likeness -1.51

Data from ChEMBL 36 via Core Engine