CHEMBL1760338


SMILES COc1ccccc1N1CCN(C(=O)c2cc(-c3ccc(Cl)cc3)n[nH]2)CC1
InChIKey DEYOMMQLWMIBRN-UHFFFAOYSA-N

Chemical properties

Hydrogen bond acceptors 4
Hydrogen bond donors 1
Rotatable bonds 4
Molecular weight (Da) 396.1

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
NK3 NK3R Rat Tachykinin A pKi 6.6 6.6 6.6 ChEMBL
NK3 NK3R Human Tachykinin A pKi 6.6 6.6 6.6 ChEMBL
NK2 NK2R Human Tachykinin A pKi 5.1 5.1 5.1 ChEMBL
NK1 NK1R Human Tachykinin A pKi 5.75 5.75 5.75 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
NK3 NK3R Human Tachykinin A pIC50 6.89 6.89 6.89 ChEMBL