CHEMBL5437660


SMILES CCc1cc(Cl)c(OC)c(N2CCN(CC[C@H]3CC[C@H](NC(=O)NC)CC3)CC2)c1
InChIKey IXCPWQZWEFUJGL-WGSAOQKQSA-N

Chemical properties

Hydrogen bond acceptors 4
Hydrogen bond donors 2
Rotatable bonds 7
Molecular weight (Da) 436.3

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
D4 DRD4 Human Dopamine A pKi 5.87 5.87 5.87 ChEMBL
D1 DRD1 Human Dopamine A pKi 5.1 5.1 5.1 ChEMBL
5-HT2B 5HT2B Human 5-Hydroxytryptamine A pKi 8.21 8.21 8.21 ChEMBL
5-HT2C 5HT2C Human 5-Hydroxytryptamine A pKi 6.79 6.79 6.79 ChEMBL
5-HT1A 5HT1A Human 5-Hydroxytryptamine A pKi 7.26 7.26 7.26 ChEMBL
D3 DRD3 Human Dopamine A pKi 9.19 9.19 9.19 ChEMBL
5-HT2A 5HT2A Human 5-Hydroxytryptamine A pKi 6.68 6.68 6.68 ChEMBL
D2 DRD2 Human Dopamine A pKi 8.24 8.24 8.24 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
D3 DRD3 Human Dopamine A pIC50 7.7 7.7 7.7 ChEMBL
D2 DRD2 Human Dopamine A pEC50 8.15 8.22 8.3 ChEMBL