CHEMBL252201


SMILES O=C(CCc1ccccc1)NC1CCc2ccc(CCN3CCN(c4nsc5ccccc45)CC3)cc21
InChIKey WLZVXPFXXASTLW-UHFFFAOYSA-N

Chemical properties

Hydrogen bond acceptors 5
Hydrogen bond donors 1
Rotatable bonds 8
Molecular weight (Da) 510.2

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
α1A ADA1A Rat Adrenoceptors A pKi 7.99 7.99 7.99 ChEMBL
5-HT2A 5HT2A Human 5-Hydroxytryptamine A pKi 9.02 9.02 9.02 ChEMBL
5-HT1A 5HT1A Human 5-Hydroxytryptamine A pKi 7.43 7.43 7.43 ChEMBL
D2 DRD2 Human Dopamine A pKi 7.48 7.48 7.48 ChEMBL
5-HT2A 5HT2A Human 5-Hydroxytryptamine A pKi 9.02 9.02 9.02 PDSP Ki database
D2 DRD2 Human Dopamine A pKi 7.48 7.48 7.48 PDSP Ki database
5-HT1A 5HT1A Human 5-Hydroxytryptamine A pKi 7.43 7.43 7.43 PDSP Ki database
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database