CHEMBL1760200


SMILES COc1ccccc1N1CCN(C(=O)c2cc(-c3ccccc3)n[nH]2)CC1
InChIKey XDXNXAQKAHUCSV-UHFFFAOYSA-N

Chemical properties

Hydrogen bond acceptors 4
Hydrogen bond donors 1
Rotatable bonds 4
Molecular weight (Da) 362.2

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
NK3 NK3R Rat Tachykinin A pKi 4.92 4.92 4.92 ChEMBL
NK2 NK2R Human Tachykinin A pKi 4.92 4.92 4.92 ChEMBL
NK1 NK1R Human Tachykinin A pKi 5.17 5.17 5.17 ChEMBL
NK3 NK3R Human Tachykinin A pKi 5.96 5.96 5.96 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
NK3 NK3R Human Tachykinin A pIC50 6.32 6.32 6.32 ChEMBL