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Compound Detail

CHEMBL1618419

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CN(C)c1ccc(/C=c2\c3cc([N+](=O)[O-])ccc3n3c2cc(-c2ccccc2)[n+]3C)cc1

Basic Information

ChEMBL ID CHEMBL1618419
Phase Preclinical
Structure Type MOL
InChI Key GYHTULPWVMYQCQ-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

423.5
MW (Da)
4.11
ALogP
4
HBA
0
HBD
54.7
PSA (Ų)
0.25
QED
0
Ro5 Violations
4
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C26H23N4O2+
MW 423.50
Aromatic Rings 5
Heavy Atoms 32
NP-Likeness -0.86

Data from ChEMBL 36 via Core Engine