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Compound Detail

CHEMBL1622348

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Cc1cccc[n+]1CC(=O)/C=C1\N(C)c2ccccc2C1(C)C

Basic Information

ChEMBL ID CHEMBL1622348
Phase Preclinical
Structure Type MOL
InChI Key SAXTWMMCBHDUBN-UYRXBGFRSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

307.4
MW (Da)
3.16
ALogP
2
HBA
0
HBD
24.2
PSA (Ų)
0.64
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 C20H23N2O+
MW 307.42
Aromatic Rings 2
Heavy Atoms 23
NP-Likeness -0.51

Data from ChEMBL 36 via Core Engine