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Compound Detail

CHEMBL58733

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O=C(c1ccccc1)c1ccn(S(=O)(=O)c2ccccc2)c1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL58733
Phase Preclinical
Structure Type MOL
InChI Key OBDINRKZIIQNMR-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
2
Publications
0
Known Names

Molecular Properties

311.4
MW (Da)
2.96
ALogP
4
HBA
0
HBD
56.1
PSA (Ų)
0.70
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 C17H13NO3S
MW 311.36
Aromatic Rings 3
Heavy Atoms 22
NP-Likeness -0.94

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