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Compound Detail

CHEMBL1183382

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COc1ccc(C(=O)CCc2cccc([N+](C)(C)C)c2)cc1OC
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1183382
Phase Preclinical
Structure Type MOL
InChI Key OJUCINSDRBBZBC-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

328.4
MW (Da)
3.72
ALogP
3
HBA
0
HBD
35.5
PSA (Ų)
0.57
QED
0
Ro5 Violations
7
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C20H26NO3+
MW 328.43
Aromatic Rings 2
Heavy Atoms 24
NP-Likeness 0.10

Data from ChEMBL 36 via Core Engine