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Compound Detail

CHEMBL148045

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O=C(CSc1nc2ccccc2[nH]1)c1ccc(O)c(C(=O)O)c1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL148045
Phase Preclinical
Structure Type MOL
InChI Key TYWKSEZDDGTXCO-UHFFFAOYSA-N
0
Targets
1
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

328.4
MW (Da)
2.94
ALogP
5
HBA
3
HBD
103.3
PSA (Ų)
0.49
QED
0
Ro5 Violations
5
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C16H12N2O4S
MW 328.35
Aromatic Rings 3
Heavy Atoms 23
NP-Likeness -1.26

Activity Summary

Ki 1 meas.

Literature References

PubMed DOI Target Context # Activities
9857085 10.1021/jm9810304 Glucagon receptor 1

Data from ChEMBL 36 via Core Engine