A-86929


SMILES CCCc1cc2c(s1)CN[C@@H]1CCc3cc(O)c(O)cc3[C@@H]21
InChIKey REHAKLRYABHSQJ-KDOFPFPSSA-N

Chemical properties

Hydrogen bond acceptors 4
Hydrogen bond donors 3
Rotatable bonds 2
Molecular weight (Da) 315.1

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
D1 DRD1 Rat Dopamine A pKi 7.85 7.85 7.85 ChEMBL
D2 DRD2 Rat Dopamine A pKi 6.1 6.1 6.1 ChEMBL
D1 DRD1 Human Dopamine A pKi 7.31 7.31 7.31 ChEMBL
D2 DRD2 Human Dopamine A pKi 6.15 6.15 6.15 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
D1 DRD1 Goldfish Dopamine A pEC50 7.62 7.62 7.62 ChEMBL
D1 DRD1 Human Dopamine A pEC50 8.05 8.05 8.05 ChEMBL
D2 DRD2 Human Dopamine A pEC50 5.41 5.41 5.41 ChEMBL