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Compound Detail

CHEMBL3138968

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CN(C)CCCCN1CCN(CCCCCCCCCOc2ccccc2)CC1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL3138968
Phase Preclinical
Structure Type MOL
InChI Key FTFNDLBIAALVFE-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

403.7
MW (Da)
4.76
ALogP
4
HBA
0
HBD
18.9
PSA (Ų)
0.37
QED
0
Ro5 Violations
16
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C25H45N3O
MW 403.66
Aromatic Rings 1
Heavy Atoms 29
NP-Likeness -0.81

Data from ChEMBL 36 via Core Engine