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Compound Detail

CHEMBL3306810

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

Basic Information

ChEMBL ID CHEMBL3306810
Phase Preclinical
Structure Type MOL
InChI Key GOMMYZHYQIZVPD-UHFFFAOYSA-P
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

400.4
MW (Da)
0.93
ALogP
6
HBA
4
HBD
131.1
PSA (Ų)
0.16
QED
0
Ro5 Violations
10
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C19H24N6O4+2
MW 400.44
Aromatic Rings 2
Heavy Atoms 29
NP-Likeness -0.25

Data from ChEMBL 36 via Core Engine