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Compound Detail

CHEMBL2079061

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C[N+](C)(C)C[C@@H]1COC[C@H](c2ccccc2)O1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL2079061
Phase Preclinical
Structure Type MOL
InChI Key VPBHPXZSVKLGMA-ZIAGYGMSSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

236.3
MW (Da)
1.85
ALogP
2
HBA
0
HBD
18.5
PSA (Ų)
0.75
QED
0
Ro5 Violations
3
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C14H22NO2+
MW 236.34
Aromatic Rings 1
Heavy Atoms 17
NP-Likeness 0.64

Data from ChEMBL 36 via Core Engine