GR 159897


SMILES COC1(CCN(CC1)CCc1c[nH]c2c1cc(F)cc2)C[S@@](=O)c1ccccc1
InChIKey BANYJBHWTOJQDU-GDLZYMKVSA-N

Chemical properties

Hydrogen bond acceptors 3
Hydrogen bond donors 1
Rotatable bonds 7
Molecular weight (Da) 414.2

Drug properties

Molecular type Small molecule
Physiological/Surrogate Surrogate
Approved drug No

Database connections

Bioactivities

Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
NK2 NK2R Human Tachykinin A pKi 9.5 9.5 9.5 ChEMBL
NK2 NK2R Human Tachykinin A pKd 7.8 8.65 9.5 Guide to Pharmacology
NK2 NK2R Rat Tachykinin A pKi 10.0 10.0 10.0 ChEMBL
NK3 NK3R Guinea pig Tachykinin A pKi 4.7 4.7 4.7 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database