CHEMBL434159


SMILES Cc1cccc2c(C(=O)CCSc3nnc(-c4ccc5ccccc5n4)n3CCCCN)c[nH]c12
InChIKey BLKXHWDWRVLQGN-UHFFFAOYSA-N

Chemical properties

Hydrogen bond acceptors 7
Hydrogen bond donors 2
Rotatable bonds 10
Molecular weight (Da) 484.2

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
SST1 SSR1 Human Somatostatin A pKi 6.28 6.28 6.28 ChEMBL
SST4 SSR4 Human Somatostatin A pKi 6.1 6.1 6.1 ChEMBL
SST5 SSR5 Human Somatostatin A pKi 9.42 9.42 9.42 ChEMBL
SST2 SSR2 Human Somatostatin A pKi 8.7 8.7 8.7 ChEMBL
SST3 SSR3 Human Somatostatin A pKi 6.77 6.77 6.77 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
SST5 SSR5 Human Somatostatin A pEC50 8.64 8.64 8.64 ChEMBL
SST2 SSR2 Human Somatostatin A pEC50 8.4 8.4 8.4 ChEMBL