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Compound Detail

CHEMBL2370640

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CCOc1ccc(C[C@H]2NC(=O)CC3(CCCCC3)SCSC[C@H](C(=O)N3CCC[C@H]3C(=O)N[C@@H](CCCN=C(N)N)C(=O)NCC(N)=O)NC(=O)[C@@H](CC(N)=O)NC(=O)[C@H](C(C)C)NC(=O)[C@@H](Cc3ccccc3)NC2=O)cc1

Basic Information

ChEMBL ID CHEMBL2370640
Phase Preclinical
Structure Type MOL
InChI Key CNLVVICQTNBGGO-ACVZXISVSA-N
2
Targets
2
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

1150.4
MW (Da)

Drug Information

Molecule Type Unknown
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C54H79N13O11S2
MW 1150.44

Activity Summary

Ki 2 meas. best 8.38

Target Activity Profile

Target Type Best pChEMBL Mean pChEMBL Best (nM) # Data
Vasopressin V2 receptor
CHEMBL1790
Ki 8.38 8.38 4.2 1
Vasopressin V2 receptor
CHEMBL3944
Ki 8.25 8.25 5.6 1

Activity Data Samples

Top measurements by pChEMBL value

Literature References

PubMed DOI Target Context # Activities
2521519 10.1021/jm00122a017 Vasopressin V2 receptor 4

Data from ChEMBL 36 via Core Engine