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Compound Detail

CHEMBL60414

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COc1ccccc1CNCCCCCCNCCCCCCCNCCCCCCN(N)Cc1ccccc1OC
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL60414
Phase Preclinical
Structure Type MOL
InChI Key MEAOYGFCVURJIU-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

583.9
MW (Da)
6.42
ALogP
7
HBA
4
HBD
83.8
PSA (Ų)
0.05
QED
2
Ro5 Violations
28
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C35H61N5O2
MW 583.91
Aromatic Rings 2
Heavy Atoms 42
NP-Likeness -0.37

Data from ChEMBL 36 via Core Engine