CHEMBL4092441


SMILES O=c1ccc2c(N3CCN(CCCCOc4ccn5nccc5c4)CC3)ccc(O)c2[nH]1
InChIKey XRIVHXPJBXAZDT-UHFFFAOYSA-N

Chemical properties

Hydrogen bond acceptors 7
Hydrogen bond donors 2
Rotatable bonds 7
Molecular weight (Da) 433.2

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 4.89 4.89 4.89 ChEMBL
D2 DRD2 Human Dopamine A pKi 8.08 8.25 8.43 ChEMBL
5-HT2A 5HT2A Human 5-Hydroxytryptamine A pKi 5.44 5.44 5.44 ChEMBL
D1 DRD1 Human Dopamine A pKi 5.33 5.33 5.33 ChEMBL
D3 DRD3 Human Dopamine A pKi 8.42 8.42 8.42 ChEMBL
D4 DRD4 Human Dopamine A pKi 7.51 7.51 7.51 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
D2 DRD2 Human Dopamine A pEC50 6.62 6.62 6.62 ChEMBL