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Compound Detail

CHEMBL1182845

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CC(C)(CN1C(=O)c2cccc3cccc(c23)C1=O)C[N+](C)(C)CCCCCC[N+](C)(C)CCCN1C(=O)c2cccc3cccc(c23)C1=O
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1182845
Phase Preclinical
Structure Type MOL
InChI Key HXRWZSLAISRLOQ-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

676.9
MW (Da)
7.01
ALogP
4
HBA
0
HBD
74.8
PSA (Ų)
0.08
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 C42H52N4O4+2
MW 676.90
Aromatic Rings 4
Heavy Atoms 50
NP-Likeness -0.12

Data from ChEMBL 36 via Core Engine