BN-81,644


SMILES CCCCC1(CCCC)N[C@H](Cc2c1[nH]c1c2cccc1)c1ncc([nH]1)c1ccccc1
InChIKey FOBFICSYUINKAA-XMMPIXPASA-N

Chemical properties

Hydrogen bond acceptors 2
Hydrogen bond donors 3
Rotatable bonds 8
Molecular weight (Da) 426.3

Drug properties

Molecular type Small molecule
Endogenous/Surrogate Surrogate
Approved drug No

Database connections

Bioactivities

Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
SST3 SSR3 Human Somatostatin A pKi 9.2 9.2 9.2 Guide to Pharmacology
SST1 SSR1 Human Somatostatin A pKi 5.43 5.43 5.43 ChEMBL
SST3 SSR3 Human Somatostatin A pKi 9.19 9.19 9.19 ChEMBL
SST4 SSR4 Human Somatostatin A pKi 5.15 5.15 5.15 ChEMBL
SST5 SSR5 Human Somatostatin A pKi 5.66 5.66 5.66 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
SST3 SSR3 Human Somatostatin A pIC50 8.57 8.57 8.57 ChEMBL