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Compound Detail

CHEMBL1789623

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COCCOC(=O)NCC[N+](C)(C)C
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1789623
Phase Preclinical
Structure Type MOL
InChI Key XMXJUVPFDQDEIR-UHFFFAOYSA-O
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

205.3
MW (Da)
0.07
ALogP
3
HBA
1
HBD
47.6
PSA (Ų)
0.49
QED
0
Ro5 Violations
6
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C9H21N2O3+
MW 205.28
Aromatic Rings 0
Heavy Atoms 14
NP-Likeness -0.32

Data from ChEMBL 36 via Core Engine