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Compound Detail

CHEMBL1182361

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CC(C)(CN1C(=O)c2cccc3cc(N)cc(c23)C1=O)C[N+](C)(C)CCCCCC[N+](C)(C)CCCN1C(=O)c2ccccc2C1=O

Basic Information

ChEMBL ID CHEMBL1182361
Phase Preclinical
Structure Type MOL
InChI Key ZIUDMKTYCFXBJP-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

641.9
MW (Da)
5.44
ALogP
5
HBA
1
HBD
100.8
PSA (Ų)
0.10
QED
2
Ro5 Violations
15
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C38H51N5O4+2
MW 641.86
Aromatic Rings 3
Heavy Atoms 47
NP-Likeness -0.18

Data from ChEMBL 36 via Core Engine