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Compound Detail

CHEMBL1616656

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COc1ccc(N=Nc2n(C)c3ccccc3[n+]2C)cc1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1616656
Phase Preclinical
Structure Type MOL
InChI Key BGYSMPFKYLADNT-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

281.3
MW (Da)
3.43
ALogP
4
HBA
0
HBD
42.8
PSA (Ų)
0.54
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 C16H17N4O+
MW 281.34
Aromatic Rings 3
Heavy Atoms 21
NP-Likeness -0.54

Data from ChEMBL 36 via Core Engine