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Compound Detail

CHEMBL4789657

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CCOC(=O)N1CCC(Oc2ncnc(Oc3cccc(/C=C4\SC(=O)NC4=O)c3)c2C)CC1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL4789657
Phase Preclinical
Structure Type MOL
InChI Key YHYCJCCNNRKNRS-PDGQHHTCSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

484.5
MW (Da)
3.90
ALogP
9
HBA
1
HBD
120.0
PSA (Ų)
0.61
QED
0
Ro5 Violations
6
Rot. Bonds

Drug Information

Molecule Type Unknown
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C23H24N4O6S
MW 484.53
Aromatic Rings 2
Heavy Atoms 34
NP-Likeness -1.24

Literature References

PubMed DOI Target Context # Activities
33611013 10.1016/j.bmc.2021.116071 Glucose-dependent insulinotropic receptor 1

Data from ChEMBL 36 via Core Engine