CHEMBL4091507


SMILES O=c1ccc2c(N3CCCN(CCCCOc4ccn5nccc5c4)CC3)ccc(O)c2[nH]1
InChIKey TYDUDPVGSUDIDV-UHFFFAOYSA-N

Chemical properties

Hydrogen bond acceptors 7
Hydrogen bond donors 2
Rotatable bonds 7
Molecular weight (Da) 447.2

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
D4 DRD4 Human Dopamine A pKi 6.72 6.72 6.72 ChEMBL
D1 DRD1 Human Dopamine A pKi 4.89 4.89 4.89 ChEMBL
D3 DRD3 Human Dopamine A pKi 8.47 8.47 8.47 ChEMBL
5-HT2A 5HT2A Human 5-Hydroxytryptamine A pKi 5.05 5.05 5.05 ChEMBL
D2 DRD2 Human Dopamine A pKi 7.11 7.22 7.34 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
D2 DRD2 Human Dopamine A pEC50 6.43 6.69 7.05 ChEMBL