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Compound Detail

CHEMBL4469555

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CCCCCCCCCCCCCCCNC(=O)Oc1ccc(C[C@@H]2NC(=O)[C@@H](NC(=O)CCCCCCCCCCCCCCC)CSSC[C@@H](C(=O)N3CCC[C@H]3C(=O)N[C@@H](CC(C)C)C(=O)NCC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H]([C@@H](C)CC)NC2=O)cc1

Basic Information

ChEMBL ID CHEMBL4469555
Phase Preclinical
Structure Type MOL
InChI Key LYMKGLACFKPIFB-IBKSBIDFSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
4
Publications
0
Known Names

Molecular Properties

1499.0
MW (Da)

Drug Information

Molecule Type Unknown
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C75H127N13O14S2
MW 1499.05

Literature References

PubMed DOI Target Context # Activities
31229420 10.1016/j.bmc.2019.06.018 Oxytocin receptor 2
31229420 10.1016/j.bmc.2019.06.018 Mus musculus 2
31229420 10.1016/j.bmc.2019.06.018 Vasopressin V1a receptor 1
31229420 10.1016/j.bmc.2019.06.018 Vasopressin V1b receptor 1

Data from ChEMBL 36 via Core Engine