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Compound Detail

CHEMBL6069507

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C(=C/c1ccc2ccccc2[n+]1CCCCCCCC[n+]1c(/C=C/c2cc3ccccc3[nH]2)ccc2ccccc21)\c1cc2ccccc2[nH]1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL6069507
Phase Preclinical
Structure Type MOL
InChI Key QTXBJEHWKXOCHD-UHFFFAOYSA-P
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

652.9
MW (Da)
10.91
ALogP
0
HBA
2
HBD
39.3
PSA (Ų)
0.09
QED
2
Ro5 Violations
13
Rot. Bonds

Drug Information

Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C46H44N4+2
MW 652.89
Aromatic Rings 8
Heavy Atoms 50
NP-Likeness -0.04

Data from ChEMBL 36 via Core Engine