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Compound Detail

CHEMBL1361764

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Cc1ccc(S(=O)(=O)N/N=C2\C(=O)Nc3cc(O)c(C(=O)O)cc32)cc1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1361764
Phase Preclinical
Structure Type MOL
InChI Key DEDQMXXUHVKGKX-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

375.4
MW (Da)
1.03
ALogP
6
HBA
4
HBD
145.2
PSA (Ų)
0.59
QED
0
Ro5 Violations
4
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C16H13N3O6S
MW 375.36
Aromatic Rings 2
Heavy Atoms 26
NP-Likeness -0.79

Literature References

PubMed DOI Target Context # Activities
22361685 10.1016/j.ejmech.2012.01.056 Human immunodeficiency virus type 1 reverse transcriptase 2

Data from ChEMBL 36 via Core Engine