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Compound Detail

CHEMBL5220909

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Cc1ccsc1-c1nnc(S)o1

Basic Information

ChEMBL ID CHEMBL5220909
Phase Preclinical
Structure Type MOL
InChI Key JFVPDKXAJAGNTR-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

198.3
MW (Da)
2.40
ALogP
5
HBA
1
HBD
38.9
PSA (Ų)
0.72
QED
0
Ro5 Violations
1
Rot. Bonds

Drug Information

Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C7H6N2OS2
MW 198.27
Aromatic Rings 2
Heavy Atoms 12
NP-Likeness -2.18

Literature References

PubMed DOI Target Context # Activities
34898210 10.1021/acs.jmedchem.1c01108 Bromodomain-containing protein 4 2

Data from ChEMBL 36 via Core Engine