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Compound Detail

CHEMBL389759

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O=C(O)Cc1[nH]cnc1I
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL389759
Phase Preclinical
Structure Type MOL
InChI Key UTLAJLJMGJNXHF-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

252.0
MW (Da)
0.64
ALogP
2
HBA
2
HBD
66.0
PSA (Ų)
0.76
QED
0
Ro5 Violations
2
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C5H5IN2O2
MW 252.01
Aromatic Rings 1
Heavy Atoms 10
NP-Likeness -0.33

Literature References

PubMed DOI Target Context # Activities
17655213 10.1021/jm070447j Unchecked 3

Data from ChEMBL 36 via Core Engine