R-VK4-40


SMILES CCc1cccc(c1Cl)N1CCN(CC1)C[C@@H](CCNC(=O)c1cc2c([nH]1)cccc2)O
InChIKey OIRZLTZLOKARTG-HXUWFJFHSA-N

Chemical properties

Hydrogen bond acceptors 4
Hydrogen bond donors 3
Rotatable bonds 8
Molecular weight (Da) 454.2

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
D2 DRD2 Human Dopamine A pKi 7.12 7.12 7.12 Guide to Pharmacology
D3 DRD3 Human Dopamine A pKi 9.54 9.54 9.54 Guide to Pharmacology
5-HT2A 5HT2A Human 5-Hydroxytryptamine A pKi 7.67 7.67 7.67 ChEMBL
5-HT1A 5HT1A Human 5-Hydroxytryptamine A pKi 6.61 6.61 6.61 ChEMBL
5-HT2C 5HT2C Human 5-Hydroxytryptamine A pKi 7.3 7.3 7.3 ChEMBL
D2 DRD2 Human Dopamine A pKi 7.12 7.12 7.12 ChEMBL
D3 DRD3 Human Dopamine A pKi 9.54 9.54 9.54 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
5-HT1A 5HT1A Human 5-Hydroxytryptamine A pEC50 5.98 5.98 5.98 ChEMBL
D3 DRD3 Human Dopamine A pIC50 7.73 7.73 7.73 ChEMBL