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Compound Detail

CHEMBL3765556

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O=C1c2ccsc2C(=O)c2c(I)cccc21
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL3765556
Phase Preclinical
Structure Type MOL
InChI Key PZACQZPLQHVPQS-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

340.1
MW (Da)
3.13
ALogP
3
HBA
0
HBD
34.1
PSA (Ų)
0.59
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 C12H5IO2S
MW 340.14
Aromatic Rings 2
Heavy Atoms 16
NP-Likeness -0.29

Literature References

PubMed DOI Target Context # Activities
26840368 10.1016/j.ejmech.2016.01.040 HaCaT 1

Data from ChEMBL 36 via Core Engine