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Compound Detail

CHEMBL6069659

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COc1ccc2c(c1)c[n+](CCO)c1cc(F)ccc21
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL6069659
Phase Preclinical
Structure Type MOL
InChI Key MZHHOCSTLKPHMW-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

272.3
MW (Da)
2.42
ALogP
2
HBA
1
HBD
33.3
PSA (Ų)
0.59
QED
0
Ro5 Violations
3
Rot. Bonds

Drug Information

Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C16H15FNO2+
MW 272.30
Aromatic Rings 3
Heavy Atoms 20
NP-Likeness -0.06

Data from ChEMBL 36 via Core Engine