CHEMBL97333


SMILES CN1CCC(CCN2CCC(c3cn(-c4ccc(F)cc4)c4ccc(-c5ncn(C)n5)cc34)CC2)C1=O
InChIKey NLEVDCFBQNJLSW-UHFFFAOYSA-N

Chemical properties

Hydrogen bond acceptors 6
Hydrogen bond donors 0
Rotatable bonds 6
Molecular weight (Da) 500.3

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 8.06 8.06 8.06 ChEMBL
α1A ADA1A Bovine Adrenoceptors A pKi 8.66 8.66 8.66 ChEMBL
α1D ADA1D Rat Adrenoceptors A pKi 7.82 7.82 7.82 ChEMBL
D1 DRD1 Rat Dopamine A pKi 5.25 5.25 5.25 ChEMBL
5-HT1B 5HT1B Human 5-Hydroxytryptamine A pKi 7.0 7.0 7.0 ChEMBL
D2 DRD2 Rat Dopamine A pKi 6.27 6.27 6.27 ChEMBL
D4 DRD4 Human Dopamine A pKi 5.14 5.14 5.14 ChEMBL
5-HT1A 5HT1A Human 5-Hydroxytryptamine A pKi 7.19 7.19 7.19 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database