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Compound Detail

CHEMBL1180370

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Cc1ccc(CN2CCC(C3CCc4ccccc4C3=O)CC2)cc1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1180370
Phase Preclinical
Structure Type MOL
InChI Key UDLOEFIJNKLNAS-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

333.5
MW (Da)
4.65
ALogP
2
HBA
0
HBD
20.3
PSA (Ų)
0.81
QED
0
Ro5 Violations
3
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C23H27NO
MW 333.48
Aromatic Rings 2
Heavy Atoms 25
NP-Likeness -0.33

Data from ChEMBL 36 via Core Engine