CHEMBL478413


SMILES c1ccc(N2CCN(CCCSc3nc4ccccc4s3)CC2)nc1
InChIKey WFKQHFRAVGTTCE-UHFFFAOYSA-N

Chemical properties

Hydrogen bond acceptors 6
Hydrogen bond donors 0
Rotatable bonds 6
Molecular weight (Da) 370.1

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
D1 DRD1 Rat Dopamine A pKi 5.25 5.25 5.25 ChEMBL
D2 DRD2 Rat Dopamine A pKi 6.33 6.33 6.33 ChEMBL
5-HT1A 5HT1A Rat 5-Hydroxytryptamine A pKi 9.11 9.11 9.11 ChEMBL
D1 DRD1 Rat Dopamine A pKi 5.25 5.25 5.25 PDSP Ki database
5-HT1A 5HT1A Rat 5-Hydroxytryptamine A pKi 9.11 9.11 9.11 PDSP Ki database
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
5-HT1A 5HT1A Rat 5-Hydroxytryptamine A pEC50 6.49 6.49 6.49 ChEMBL