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Compound Detail

CHEMBL151810

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Nc1ccc(Cl)c(S(=O)(=O)n2ccc3ccccc32)c1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL151810
Phase Preclinical
Structure Type MOL
InChI Key MQUMCKWSVIPCBU-UHFFFAOYSA-N
0
Targets
2
Activities
1
Assay Types
0
PK Parameters
2
Publications
0
Known Names

Molecular Properties

306.8
MW (Da)
3.11
ALogP
4
HBA
1
HBD
65.1
PSA (Ų)
0.74
QED
0
Ro5 Violations
2
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C14H11ClN2O2S
MW 306.77
Aromatic Rings 3
Heavy Atoms 20
NP-Likeness -1.43

Activity Summary

EC50 2 meas.

Literature References

PubMed DOI Target Context # Activities
8558522 10.1021/jm950568w MT4 3
15634015 10.1021/jm040854k MT4 1

Data from ChEMBL 36 via Core Engine