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Compound Detail

CHEMBL5205075

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CCN(CC)CCOc1cc(-c2ccc(Cl)s2)nc2ccccc12
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL5205075
Phase Preclinical
Structure Type MOL
InChI Key OJIFKISSJZHPLN-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

360.9
MW (Da)
5.34
ALogP
4
HBA
0
HBD
25.4
PSA (Ų)
0.57
QED
1
Ro5 Violations
7
Rot. Bonds

Drug Information

Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C19H21ClN2OS
MW 360.91
Aromatic Rings 3
Heavy Atoms 24
NP-Likeness -1.63

Literature References

PubMed DOI Target Context # Activities
35571875 10.1021/acsmedchemlett.2c00123 SARS-CoV-2 1

Data from ChEMBL 36 via Core Engine