CHEMBL328187


SMILES Cn1cc(-c2ccc3c(c2)c(C2CCN(CCN4CCNC4=O)CC2)cn3-c2ccc(F)cc2)nn1
InChIKey DUTDDZFCPPOWFH-UHFFFAOYSA-N

Chemical properties

Hydrogen bond acceptors 6
Hydrogen bond donors 1
Rotatable bonds 6
Molecular weight (Da) 487.3

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
α1B ADA1B Golden hamster Adrenoceptors A pKi 8.22 8.22 8.22 ChEMBL
α1A ADA1A Bovine Adrenoceptors A pKi 8.52 8.52 8.52 ChEMBL
α1D ADA1D Rat Adrenoceptors A pKi 8.07 8.07 8.07 ChEMBL
H1 HRH1 Human Histamine A pKi 5.82 5.82 5.82 ChEMBL
D2 DRD2 Rat Dopamine A pKi 6.51 6.51 6.51 ChEMBL
5-HT2C 5HT2C Human 5-Hydroxytryptamine A pKi 6.96 6.96 6.96 ChEMBL
D2 DRD2 Human Dopamine A pKi 6.51 6.51 6.51 ChEMBL
5-HT1A 5HT1A Human 5-Hydroxytryptamine A pKi 7.54 7.54 7.54 ChEMBL
5-HT1B 5HT1B Human 5-Hydroxytryptamine A pKi 7.44 7.44 7.44 ChEMBL
5-HT2C 5HT2C Rat 5-Hydroxytryptamine A pKi 5.82 5.82 5.82 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database