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Compound Detail

CHEMBL1423114

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Cc1ccc(-n2c(C)nn(Cc3ccc([N+](=O)[O-])cc3)c2=O)cc1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1423114
Phase Preclinical
Structure Type MOL
InChI Key FHNGOFQMXWQMON-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

324.3
MW (Da)
2.61
ALogP
6
HBA
0
HBD
83.0
PSA (Ų)
0.55
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 C17H16N4O3
MW 324.34
Aromatic Rings 3
Heavy Atoms 24
NP-Likeness -1.83

Data from ChEMBL 36 via Core Engine