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Compound Detail

CHEMBL3307086

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c1ccc(C[n+]2cc3ccccc3c3ccccc32)cc1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL3307086
Phase Preclinical
Structure Type MOL
InChI Key FPICCCMYXYWYNL-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

270.4
MW (Da)
4.33
ALogP
0
HBA
0
HBD
3.9
PSA (Ų)
0.38
QED
0
Ro5 Violations
2
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C20H16N+
MW 270.36
Aromatic Rings 4
Heavy Atoms 21
NP-Likeness -0.10

Data from ChEMBL 36 via Core Engine