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Compound Detail

CHEMBL3039744

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N/C(=N\O)c1ccc(COc2ccc(/C(N)=N/O)cc2I)cc1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL3039744
Phase Preclinical
Structure Type MOL
InChI Key QQZXQPSNMSMBBO-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

426.2
MW (Da)
2.06
ALogP
5
HBA
4
HBD
126.5
PSA (Ų)
0.19
QED
0
Ro5 Violations
5
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C15H15IN4O3
MW 426.21
Aromatic Rings 2
Heavy Atoms 23
NP-Likeness -0.74

Data from ChEMBL 36 via Core Engine