CHEMBL538451


SMILES CN(C(=O)c1ccc2ccccc2c1)[C@H]1NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@H](NC(=O)[C@@H](N)Cc2ccc(C(N)=O)cc2)CSSC[C@@H](C(=O)N[C@@H](Cc2ccc3ccccc3c2)C(N)=O)NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@H](CCCCN)NC1=O
InChIKey DYTJXQNGJXFRFI-WVYQZIAPSA-N

Chemical properties

Hydrogen bond acceptors 14
Hydrogen bond donors 11
Rotatable bonds 20
Molecular weight (Da) 1270.5

Drug properties

Molecular type Small molecule
Physiological/Surrogate Surrogate
Approved drug No

Database connections

Sankey plot

Compound is not listed as a drug.

Bioactivities

Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
SST4 SSR4 Human Somatostatin A pIC50 7.15 7.15 7.15 ChEMBL
SST5 SSR5 Human Somatostatin A pIC50 8.0 8.0 8.0 ChEMBL
SST2 SSR2 Human Somatostatin A pIC50 7.0 7.0 7.0 ChEMBL
SST3 SSR3 Human Somatostatin A pIC50 7.77 7.77 7.77 ChEMBL
SST1 SSR1 Human Somatostatin A pIC50 7.7 7.7 7.7 ChEMBL