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Compound Detail

CHEMBL5402762

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Cn1cnc(S(=O)(=O)n2nc(N)nc2Nc2ccc(Cl)cc2)c1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL5402762
Phase Preclinical
Structure Type MOL
InChI Key QDFVUSGOOJMOSP-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

353.8
MW (Da)
1.23
ALogP
9
HBA
2
HBD
120.7
PSA (Ų)
0.72
QED
0
Ro5 Violations
4
Rot. Bonds

Drug Information

Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C12H12ClN7O2S
MW 353.80
Aromatic Rings 3
Heavy Atoms 23
NP-Likeness -1.66

Literature References

PubMed DOI Target Context # Activities
37130343 10.1021/acs.jmedchem.2c02055 Human immunodeficiency virus 1 2

Data from ChEMBL 36 via Core Engine