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Compound Detail

CHEMBL4300399

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COc1ccccc1N1CCN(CCOCCOc2cc(C)cc(C)c2C)CC1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL4300399
Phase Preclinical
Structure Type MOL
InChI Key JJACJGJMQKKPIZ-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

398.6
MW (Da)
3.84
ALogP
5
HBA
0
HBD
34.2
PSA (Ų)
0.60
QED
0
Ro5 Violations
9
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C24H34N2O3
MW 398.55
Aromatic Rings 2
Heavy Atoms 29
NP-Likeness -1.36

Data from ChEMBL 36 via Core Engine