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Compound Detail

CHEMBL60329

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COc1ccccc1CNCCCCCCNCCCCCCCCCCNCCCCCCNCc1ccccc1OC
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL60329
Phase Preclinical
Structure Type MOL
InChI Key BRMKEVBAZDNRPY-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

611.0
MW (Da)
8.00
ALogP
6
HBA
4
HBD
66.6
PSA (Ų)
0.06
QED
2
Ro5 Violations
31
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C38H66N4O2
MW 610.97
Aromatic Rings 2
Heavy Atoms 44
NP-Likeness -0.20

Data from ChEMBL 36 via Core Engine