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Compound Detail

CHEMBL149067

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Oc1ccc(/C(CSc2nc3ccccc3[nH]2)=N\OCc2ccccc2)cc1Cl
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL149067
Phase Preclinical
Structure Type MOL
InChI Key WENDKNAMAIEMQU-QOMWVZHYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

423.9
MW (Da)
5.64
ALogP
5
HBA
2
HBD
70.5
PSA (Ų)
0.23
QED
1
Ro5 Violations
7
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C22H18ClN3O2S
MW 423.93
Aromatic Rings 4
Heavy Atoms 29
NP-Likeness -1.28

Literature References

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

Data from ChEMBL 36 via Core Engine