CHEMBL459373


SMILES CN(CCCN1c2ccccc2Sc2ccc(Cl)cc21)Cc1ccc(OCCCN2CCCCC2)cc1
InChIKey UCQNMJXTWOYVNH-UHFFFAOYSA-N

Chemical properties

Hydrogen bond acceptors 5
Hydrogen bond donors 0
Rotatable bonds 11
Molecular weight (Da) 535.2

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
D5 DRD5 Human Dopamine A pKi 6.82 6.82 6.82 ChEMBL
H1 HRH1 Human Histamine A pKi 6.69 6.69 6.69 ChEMBL
D1 DRD1 Human Dopamine A pKi 6.63 6.63 6.63 ChEMBL
H3 HRH3 Human Histamine A pKi 8.92 8.92 8.92 ChEMBL
D3 DRD3 Human Dopamine A pKi 7.3 7.3 7.3 ChEMBL
D2 DRD2 Human Dopamine A pKi 7.39 7.39 7.39 ChEMBL
D1 DRD1 Human Dopamine A pKi 6.63 6.63 6.63 PDSP Ki database
H1 HRH1 Human Histamine A pKi 6.69 6.69 6.69 PDSP Ki database
H3 HRH3 Human Histamine A pKi 8.92 8.92 8.92 PDSP Ki database
D2 DRD2 Human Dopamine A pKi 7.39 7.39 7.39 PDSP Ki database
D3 DRD3 Human Dopamine A pKi 7.3 7.3 7.3 PDSP Ki database
D5 DRD5 Human Dopamine A pKi 6.82 6.82 6.82 PDSP Ki database
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database