CHEMBL478617


SMILES O=C(CCCN1C2CCC1CC(O)(c1ccccc1)C2)c1ccc(F)cc1
InChIKey CPDKHEPGGZULPR-UHFFFAOYSA-N

Chemical properties

Hydrogen bond acceptors 3
Hydrogen bond donors 1
Rotatable bonds 6
Molecular weight (Da) 367.2

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
H1 HRH1 Human Histamine A pKi 6.2 6.2 6.2 ChEMBL
D4 DRD4 Human Dopamine A pKi 7.72 7.72 7.72 ChEMBL
5-HT1A 5HT1A Human 5-Hydroxytryptamine A pKi 7.42 7.42 7.42 ChEMBL
D2 DRD2 Human Dopamine A pKi 8.64 8.64 8.64 ChEMBL
5-HT2C 5HT2C Human 5-Hydroxytryptamine A pKi 5.0 5.0 5.0 PDSP Ki database
D2 DRD2 Human Dopamine A pKi 8.64 8.64 8.64 PDSP Ki database
5-HT1A 5HT1A Human 5-Hydroxytryptamine A pKi 7.42 7.42 7.42 PDSP Ki database
5-HT2A 5HT2A Human 5-Hydroxytryptamine A pKi 7.91 7.91 7.91 PDSP Ki database
H1 HRH1 Human Histamine A pKi 6.2 6.2 6.2 PDSP Ki database
5-HT2A 5HT2A Human 5-Hydroxytryptamine A pKi 7.91 7.91 7.91 ChEMBL
D4 DRD4 Human Dopamine A pKi 7.72 7.72 7.72 PDSP Ki database
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database