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Compound Detail

CHEMBL6070681

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COc1ccc(-c2cc3c(cc2OC)c[n+](CCO)c2ccc(F)cc32)cc1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL6070681
Phase Preclinical
Structure Type MOL
InChI Key JYSSZSILYNCVAC-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

378.4
MW (Da)
4.10
ALogP
3
HBA
1
HBD
42.6
PSA (Ų)
0.42
QED
0
Ro5 Violations
5
Rot. Bonds

Drug Information

Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C23H21FNO3+
MW 378.42
Aromatic Rings 4
Heavy Atoms 28
NP-Likeness -0.05

Data from ChEMBL 36 via Core Engine