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Compound Detail

CHEMBL269023

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CC(C)NCc1ccc(C[C@@H]2NC(=O)[C@H](Cc3c[nH]c4ccccc34)NC(=O)[C@H]3CCC(=O)NCCC(=O)NCCC[C@@H](NC(=O)[C@H](Cc4ccccc4)NC(=O)[C@@H]([C@@H](C)O)NC2=O)C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)O)CSSC[C@@H](NC(=O)[C@@H](N)Cc2ccc(O)cc2)C(=O)N[C@H](CCCCN)C(=O)N[C@H](Cc2ccccc2)C(=O)N3)cc1

Basic Information

ChEMBL ID CHEMBL269023
Phase Preclinical
Structure Type MOL
InChI Key VOQCSJWRURFRIS-SFYPIHDGSA-N
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
5
Publications
0
Known Names

Molecular Properties

1697.0
MW (Da)

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C83H109N17O18S2
MW 1697.02

Activity Summary

IC50 1 meas. best 7.19

Target Activity Profile

Target Type Best pChEMBL Mean pChEMBL Best (nM) # Data
Somatostatin receptor type 1
CHEMBL1917
IC50 7.19 7.19 64.0 1

Activity Data Samples

Top measurements by pChEMBL value

Literature References

PubMed DOI Target Context # Activities
15658865 10.1021/jm049519m Somatostatin receptor type 1 1
15658865 10.1021/jm049519m Somatostatin receptor type 2 1
15658865 10.1021/jm049519m Somatostatin receptor type 3 1
15658865 10.1021/jm049519m Somatostatin receptor type 4 1
15658865 10.1021/jm049519m Somatostatin receptor type 5 1

Data from ChEMBL 36 via Core Engine