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Compound Detail

CHEMBL6069607

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COc1ccc2c(c1)c[n+](CCO)c1ccc(OC)cc21
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL6069607
Phase Preclinical
Structure Type MOL
InChI Key ZMZJRUYECUSVMI-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

284.3
MW (Da)
2.29
ALogP
3
HBA
1
HBD
42.6
PSA (Ų)
0.59
QED
0
Ro5 Violations
4
Rot. Bonds

Drug Information

Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C17H18NO3+
MW 284.34
Aromatic Rings 3
Heavy Atoms 21
NP-Likeness 0.30

Data from ChEMBL 36 via Core Engine