CHEMBL1760205


SMILES COc1ccccc1N1CCN(C(=O)c2cc(-c3ccc(Cl)cc3)nn2C)CC1
InChIKey SIYPEYKSXSWWFT-UHFFFAOYSA-N

Chemical properties

Hydrogen bond acceptors 5
Hydrogen bond donors 0
Rotatable bonds 4
Molecular weight (Da) 410.2

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
NK3 NK3R Rat Tachykinin A pKi 5.43 5.43 5.43 ChEMBL
NK3 NK3R Human Tachykinin A pKi 6.27 6.27 6.27 ChEMBL
NK2 NK2R Human Tachykinin A pKi 5.0 5.0 5.0 ChEMBL
NK1 NK1R Human Tachykinin A pKi 5.66 5.66 5.66 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
NK3 NK3R Human Tachykinin A pIC50 6.75 6.75 6.75 ChEMBL