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Compound Detail

CHEMBL1182811

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c1ccc(-c2ccc[n+](CCCCCc3cc(CCCCC[n+]4cccc(-c5ccccc5)c4)cc(CCCCC[n+]4cccc(-c5ccccc5)c4)c3)c2)cc1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1182811
Phase Preclinical
Structure Type MOL
InChI Key CDNFAKVJGFHDDB-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

751.1
MW (Da)
11.79
ALogP
0
HBA
0
HBD
11.6
PSA (Ų)
0.05
QED
2
Ro5 Violations
21
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C54H60N3+3
MW 751.10
Aromatic Rings 7
Heavy Atoms 57
NP-Likeness 0.05

Data from ChEMBL 36 via Core Engine