CHEMBL4780335


SMILES C[C@H]1CN(CC[C@H]2CC[C@H](NC(=O)c3ccco3)CC2)CCc2ccc(Cl)cc21
InChIKey KHPOIBBWMVNTMI-WFXMLNOXSA-N

Chemical properties

Hydrogen bond acceptors 3
Hydrogen bond donors 1
Rotatable bonds 5
Molecular weight (Da) 414.2

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
H1 HRH1 Human Histamine A pKi 7.09 7.09 7.09 ChEMBL
5-HT1A 5HT1A Human 5-Hydroxytryptamine A pKi 7.01 7.01 7.01 ChEMBL
5-HT2A 5HT2A Human 5-Hydroxytryptamine A pKi 7.11 7.11 7.11 ChEMBL
D3 DRD3 Human Dopamine A pKi 6.99 6.99 6.99 ChEMBL
D2 DRD2 Human Dopamine A pKi 7.03 7.03 7.03 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database