CHEMBL500230


SMILES O=C(Nc1ccc2[nH]cc(C3CCN(CCCCCCCCCCN4CCC(c5c[nH]c6ccc(NC(=O)c7ccc(F)cc7)cc56)CC4)CC3)c2c1)c1ccc(F)cc1
InChIKey YSVHRLXDIVLSIZ-UHFFFAOYSA-N

Chemical properties

Hydrogen bond acceptors 4
Hydrogen bond donors 4
Rotatable bonds 17
Molecular weight (Da) 812.5

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
5-HT1B 5HT1B Human 5-Hydroxytryptamine A pKi 7.42 7.42 7.42 ChEMBL
5-HT1B 5HT1B Human 5-Hydroxytryptamine A pKi 7.42 7.42 7.42 PDSP Ki database
5-HT1D 5HT1D Human 5-Hydroxytryptamine A pKi 7.89 7.89 7.89 PDSP Ki database
5-HT1D 5HT1D Human 5-Hydroxytryptamine A pKi 7.89 7.89 7.89 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database