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Compound Detail

CHEMBL61187

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Cc1ccc(C(=O)c2ccn(S(=O)(=O)c3ccccc3)c2)cc1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL61187
Phase Preclinical
Structure Type MOL
InChI Key JXOXUPCGRKCWKC-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
2
Publications
0
Known Names

Molecular Properties

325.4
MW (Da)
3.26
ALogP
4
HBA
0
HBD
56.1
PSA (Ų)
0.69
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 C18H15NO3S
MW 325.39
Aromatic Rings 3
Heavy Atoms 23
NP-Likeness -1.09

Literature References

PubMed DOI Target Context # Activities
- 10.1016/S0960-894X(97)00340-5 MT4 1
- 10.1016/S0960-894X(97)00340-5 Human immunodeficiency virus 1 1

Data from ChEMBL 36 via Core Engine