CHEMBL281200


SMILES NCCCCCOC[C@H]1O[C@@H](OCCc2c[nH]c3ccccc23)[C@H](OCc2ccccc2)C[C@@H]1OCc1ccccc1
InChIKey OTXSDJOFSVUWCT-FZCXESBVSA-N

Chemical properties

Hydrogen bond acceptors 6
Hydrogen bond donors 2
Rotatable bonds 17
Molecular weight (Da) 572.3

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
SST1 SSR1 Human Somatostatin A pKi 5.39 5.39 5.39 ChEMBL
SST4 SSR4 Human Somatostatin A pKi 5.77 5.77 5.77 ChEMBL
SST2 SSR2 Human Somatostatin A pKi 5.51 5.51 5.51 ChEMBL
SST5 SSR5 Human Somatostatin A pKi 5.29 5.29 5.29 ChEMBL
SST3 SSR3 Human Somatostatin A pKi 5.48 5.48 5.48 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
NK1 NK1R Human Tachykinin A pIC50 6.75 6.75 6.75 ChEMBL
β2 ADRB2 Human Adrenoceptors A pIC50 5.52 5.52 5.52 ChEMBL