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Compound Detail

CHEMBL1179752

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CCN(CC)CCC1COC(c2ccccc2)(c2ccccc2)C1=O
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1179752
Phase Preclinical
Structure Type MOL
InChI Key WEXCAOVXRGYBPP-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

337.5
MW (Da)
3.88
ALogP
3
HBA
0
HBD
29.5
PSA (Ų)
0.77
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 C22H27NO2
MW 337.46
Aromatic Rings 2
Heavy Atoms 25
NP-Likeness -0.08

Data from ChEMBL 36 via Core Engine