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Compound Detail

CHEMBL4470837

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Cc1cc(S(=O)(=O)NN=C(c2ccccc2)c2ccccc2)c(C)cc1Cl
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL4470837
Phase Preclinical
Structure Type MOL
InChI Key MCRZUYARLYMSJH-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

398.9
MW (Da)
4.69
ALogP
3
HBA
1
HBD
58.5
PSA (Ų)
0.50
QED
0
Ro5 Violations
5
Rot. Bonds

Drug Information

Molecule Type Unknown
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C21H19ClN2O2S
MW 398.92
Aromatic Rings 3
Heavy Atoms 27
NP-Likeness -1.24

Literature References

PubMed DOI Target Context # Activities
30738655 10.1016/j.bmc.2019.01.043 Bacterial urease 1

Data from ChEMBL 36 via Core Engine