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Compound Detail

CHEMBL1184228

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COc1ccccc1N1CCN(CCCCNC(=O)CCc2ccccc2)CC1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1184228
Phase Preclinical
Structure Type MOL
InChI Key KSWVNKXYQFPTSL-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

395.6
MW (Da)
3.35
ALogP
4
HBA
1
HBD
44.8
PSA (Ų)
0.63
QED
0
Ro5 Violations
10
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C24H33N3O2
MW 395.55
Aromatic Rings 2
Heavy Atoms 29
NP-Likeness -1.20

Data from ChEMBL 36 via Core Engine