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Compound Detail

CHEMBL3105165

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Cc1cccc(S(=O)(=O)NCc2ccc(C(=O)Nc3cccnc3)cc2)c1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL3105165
Phase Preclinical
Structure Type MOL
InChI Key WBZDXMJBOFKVSN-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
2
Publications
0
Known Names

Molecular Properties

381.5
MW (Da)
3.12
ALogP
4
HBA
2
HBD
88.2
PSA (Ų)
0.69
QED
0
Ro5 Violations
6
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C20H19N3O3S
MW 381.46
Aromatic Rings 3
Heavy Atoms 27
NP-Likeness -2.06

Literature References

PubMed DOI Target Context # Activities
24387866 10.1016/j.bmc.2013.12.028 Unchecked 1
24387866 10.1016/j.bmc.2013.12.028 NON-PROTEIN TARGET 1

Data from ChEMBL 36 via Core Engine