CHEMBL177031


SMILES O=C(NCCN1CCN(C2CCCc3ccccc32)CC1)c1ccc(Cl)cc1
InChIKey FGNDDXTVXSKQJK-UHFFFAOYSA-N

Chemical properties

Hydrogen bond acceptors 3
Hydrogen bond donors 1
Rotatable bonds 5
Molecular weight (Da) 397.2

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 Bovine Dopamine A pKi 4.57 4.64 4.71 ChEMBL
5-HT2C 5HT2C Human 5-Hydroxytryptamine A pKi 5.65 5.92 6.19 ChEMBL
D3 DRD3 Human Dopamine A pKi 5.66 5.67 5.68 ChEMBL
5-HT1A 5HT1A Rat 5-Hydroxytryptamine A pKi 6.68 7.69 8.4 ChEMBL
D2 DRD2 Bovine Dopamine A pKi 6.16 6.47 6.92 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
5-HT1A 5HT1A Rat 5-Hydroxytryptamine A pIC50 5.82 6.79 7.42 ChEMBL