NGD 94-1


SMILES c1ccc(cc1)c1ncc([nH]1)CN1CCN(CC1)c1ncccn1
InChIKey OTVQCHUIPJYASM-UHFFFAOYSA-N

Chemical properties

Hydrogen bond acceptors 5
Hydrogen bond donors 1
Rotatable bonds 4
Molecular weight (Da) 320.2

Drug properties

Molecular type Small molecule
Endogenous/Surrogate Surrogate
Approved drug No

Database connections

Ligand site mutations D4

Bioactivities

Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
D4 DRD4 Rat Dopamine A pKi 9.5 9.5 9.5 Guide to Pharmacology
D4 DRD4 Human Dopamine A pKd 8.3 8.3 8.3 Guide to Pharmacology
D4 DRD4 Human Dopamine A pKi 8.42 8.43 8.44 ChEMBL
5-HT1A 5HT1A Human 5-Hydroxytryptamine A pKi 6.74 6.75 6.75 ChEMBL
D2 DRD2 Human Dopamine A pKi 5.65 5.65 5.65 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database