CHEMBL115280


SMILES O=C1NCN(c2ccccc2)C12CCN(Cc1cccc(Oc3ccccc3)c1)CC2
InChIKey SKVXOYIMICHFPV-UHFFFAOYSA-N

Chemical properties

Hydrogen bond acceptors 4
Hydrogen bond donors 1
Rotatable bonds 5
Molecular weight (Da) 413.2

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
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
NOP OPRX Human Opioid A pIC50 5.62 5.62 5.62 ChEMBL
β1 ADRB1 Human Adrenoceptors A pIC50 5.45 5.45 5.45 ChEMBL
H1 HRH1 Human Histamine A pIC50 6.3 6.3 6.3 ChEMBL
M2 ACM2 Human Acetylcholine (muscarinic) A pIC50 5.34 5.34 5.34 ChEMBL
D3 DRD3 Human Dopamine A pIC50 6.83 6.83 6.83 ChEMBL
δ OPRD Human Opioid A pIC50 5.74 5.74 5.74 ChEMBL
κ OPRK Human Opioid A pIC50 7.0 7.0 7.0 ChEMBL
μ OPRM Human Opioid A pIC50 7.08 7.08 7.08 ChEMBL
D2 DRD2 Human Dopamine A pIC50 6.27 6.27 6.27 ChEMBL