Rotigotine


SMILES CCCN([C@H]1CCc2c(C1)cccc2O)CCc1cccs1
InChIKey KFQYTPMOWPVWEJ-INIZCTEOSA-N

Chemical properties

Hydrogen bond acceptors 3
Hydrogen bond donors 1
Rotatable bonds 6
Molecular weight (Da) 315.2

Drug properties

Molecular type Small molecule
Endogenous/Surrogate Surrogate
Approved drug Yes

Database connections

Ligand site mutations D2

Bioactivity

Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
D1 DRD1 Human Dopamine A pKi 5.6 5.6 5.6 Guide to Pharmacology
D2 DRD2 Human Dopamine A pKi 10.22 10.22 10.22 Guide to Pharmacology
D3 DRD3 Human Dopamine A pKi 8.4 8.4 8.4 Guide to Pharmacology
D4 DRD4 Human Dopamine A pKi 7.26 7.26 7.26 Guide to Pharmacology
D5 DRD5 Human Dopamine A pKi 6.0 6.0 6.0 Guide to Pharmacology
D1 DRD1 Bovine Dopamine A pKi 6.3 6.3 6.3 ChEMBL
D2 DRD2 Bovine Dopamine A pKi 7.82 7.82 7.82 ChEMBL
D1 DRD1 Human Dopamine A pEC50 7.55 7.55 7.55 ChEMBL
D4 DRD4 Human Dopamine A pKi 7.26 7.26 7.26 ChEMBL
D3 DRD3 Human Dopamine A pKi 8.4 8.4 8.4 ChEMBL
D2 DRD2 Human Dopamine A pKi 7.7 9.38 10.22 ChEMBL
D2 DRD2 Human Dopamine A pEC50 8.36 8.6 9.15 ChEMBL
D1 DRD1 Human Dopamine A pKi 7.25 7.25 7.25 Drug Central
D2 DRD2 Human Dopamine A pKi 6.99 6.99 6.99 Drug Central
D3 DRD3 Human Dopamine A pKi 7.08 7.08 7.08 Drug Central
D5 DRD5 Human Dopamine A pKi 7.22 7.22 7.22 Drug Central
D4 DRD4 Human Dopamine A pKi 7.14 7.14 7.14 Drug Central
D1 DRD1 Bovine Dopamine A pKi 7.2 7.2 7.2 Drug Central
D2 DRD2 Bovine Dopamine A pKi 7.11 7.11 7.11 Drug Central