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Compound Detail

CHEMBL3306780

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O=C(/C=N\O)Nc1ccc[n+](CCC[n+]2cccc(NC(=O)/C=N\O)c2)c1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL3306780
Phase Preclinical
Structure Type MOL
InChI Key BWGWZHHGOKOHGO-UHFFFAOYSA-P
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

372.4
MW (Da)
0.15
ALogP
6
HBA
4
HBD
131.1
PSA (Ų)
0.23
QED
0
Ro5 Violations
8
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C17H20N6O4+2
MW 372.39
Aromatic Rings 2
Heavy Atoms 27
NP-Likeness -0.29

Data from ChEMBL 36 via Core Engine