CHEMBL374973


SMILES CN1CCC(c2c[nH]c3ccc(NC(=O)CCCCCCCCCCCC(=O)Nc4ccc5[nH]cc(C6CCN(C)CC6)c5c4)cc23)CC1
InChIKey BQCCESCADFCCQW-UHFFFAOYSA-N

Chemical properties

Hydrogen bond acceptors 4
Hydrogen bond donors 4
Rotatable bonds 16
Molecular weight (Da) 666.5

Drug properties

Molecular type Small molecule
Physiological/Surrogate Surrogate
Approved drug No

Database connections

Sankey plot

Compound is not listed as a drug.

Bioactivities

Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
5-HT1B 5HT1B Human 5-Hydroxytryptamine A pKi 10.0 10.0 10.0 ChEMBL
5-HT1D 5HT1D Human 5-Hydroxytryptamine A pKi 8.85 8.85 8.85 ChEMBL
5-HT1B 5HT1B Human 5-Hydroxytryptamine A pKi 10.0 10.0 10.0 PDSP Ki database
5-HT1D 5HT1D Human 5-Hydroxytryptamine A pKi 8.85 8.85 8.85 PDSP Ki database
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database