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Compound Detail

CHEMBL5095825

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COc1ccc(C(CCCN2CCOCC2)c2ccc(C)cc2)cc1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL5095825
Phase Preclinical
Structure Type MOL
InChI Key WZRZTLFZGKDSGW-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

339.5
MW (Da)
4.25
ALogP
3
HBA
0
HBD
21.7
PSA (Ų)
0.75
QED
0
Ro5 Violations
7
Rot. Bonds

Drug Information

Molecule Type Unknown
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C22H29NO2
MW 339.48
Aromatic Rings 2
Heavy Atoms 25
NP-Likeness -0.85

Data from ChEMBL 36 via Core Engine