CHEMBL4085920


SMILES CC(C)(C)c1nc(N2CCN(CCCCNC(=O)c3cc4ccccn4n3)CC2)cc(C(F)(F)F)n1
InChIKey UXRJVZYJCCSIAH-UHFFFAOYSA-N

Chemical properties

Hydrogen bond acceptors 7
Hydrogen bond donors 1
Rotatable bonds 7
Molecular weight (Da) 503.3

Drug properties

Molecular type Small molecule
Endogenous/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 5.24 5.24 5.24 ChEMBL
D1 DRD1 Human Dopamine A pKi 5.12 5.12 5.12 ChEMBL
D4 DRD4 Human Dopamine A pKi 5.33 5.33 5.33 ChEMBL
5-HT2A 5HT2A Human 5-Hydroxytryptamine A pKi 5.57 5.57 5.57 ChEMBL
D3 DRD3 Human Dopamine A pKi 8.92 8.92 8.92 ChEMBL
D2 DRD2 Human Dopamine A pKi 6.37 6.54 6.7 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database