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Compound Detail

CHEMBL555452

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CC(C)[C@@H]1NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@H](C(c2ccccc2)c2ccccc2)NC(=O)CCSSC[C@@H](C(=O)N2CCC[C@H]2C(=O)N[C@H](CCCNC(=N)N)C(=O)NCC(N)=O)NC(=O)[C@H](CC(N)=O)NC1=O

Basic Information

ChEMBL ID CHEMBL555452
Phase Preclinical
Structure Type MOL
InChI Key JZJJYUZXSSJSRW-BNGVKBMASA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
3
Publications
0
Known Names

Molecular Properties

1100.3
MW (Da)

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C52H69N13O10S2
MW 1100.34

Literature References

PubMed DOI Target Context # Activities
19418631 10.1016/j.ejmech.2008.12.010 Rattus norvegicus 11
19418631 10.1016/j.ejmech.2008.12.010 Oxytocin receptor 2
19418631 10.1016/j.ejmech.2008.12.010 Vasopressin V1a receptor 1

Data from ChEMBL 36 via Core Engine