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Compound Detail

CHEMBL6068652

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C(=C/c1ccc2ccccc2[n+]1CCCCCCCC[n+]1c(/C=C/c2ccc(N3CCOCC3)cc2)ccc2ccccc21)\c1ccc(N2CCOCC2)cc1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL6068652
Phase Preclinical
Structure Type MOL
InChI Key FOPQPDWRVUVUNS-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

745.0
MW (Da)
9.62
ALogP
4
HBA
0
HBD
32.7
PSA (Ų)
0.08
QED
2
Ro5 Violations
15
Rot. Bonds

Drug Information

Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C50H56N4O2+2
MW 745.02
Aromatic Rings 6
Heavy Atoms 56
NP-Likeness -0.31

Data from ChEMBL 36 via Core Engine