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Compound Detail

CHEMBL1184426

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CCCCCCCCCCCCCCOc1ccc(C(=O)N(Cc2cccc[n+]2Cc2ccccc2)C(C)=O)cc1

Basic Information

ChEMBL ID CHEMBL1184426
Phase Preclinical
Structure Type MOL
InChI Key MZVMFWGUHGINRY-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

557.8
MW (Da)
8.29
ALogP
3
HBA
0
HBD
50.5
PSA (Ų)
0.11
QED
2
Ro5 Violations
19
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C36H49N2O3+
MW 557.80
Aromatic Rings 3
Heavy Atoms 41
NP-Likeness -0.38

Data from ChEMBL 36 via Core Engine