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Compound Detail

CHEMBL4300028

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Fc1cccc2c1-c1ccccc1[I+]2
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL4300028
Phase Preclinical
Structure Type MOL
InChI Key PMAQXLFANCOORG-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

297.1
MW (Da)
-0.07
ALogP
0
HBA
0
HBD
0.0
PSA (Ų)
0.51
QED
0
Ro5 Violations
0
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C12H7FI+
MW 297.09
Aromatic Rings 2
Heavy Atoms 14
NP-Likeness -0.72

Literature References

PubMed DOI Target Context # Activities
37541631 10.1016/j.bmcl.2023.129427 G-protein coupled receptor 3 2

Data from ChEMBL 36 via Core Engine