T3-CLK-N


SMILES CN1CCN(C(=O)C(C)(C)c2ccc(C(=O)Nc3cn4cc(-c5cc(C(C)(C)C)cc(C(C)(C)C)c5)ccc4n3)cc2)CC1
InChIKey BNTGVINQADRYBE-UHFFFAOYSA-N

Chemical properties

Hydrogen bond acceptors None
Hydrogen bond donors None
Rotatable bonds None
Molecular weight (Da)

Drug properties

Molecular type Na
Physiological/Surrogate Surrogate
Approved drug No

Database connections

Sankey plot

Compound is not listed as a drug.

Bioactivities

Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
5-HT1E 5HT1E Human 5-Hydroxytryptamine A pKi 5.45 5.45 5.46 ChEMBL
5-HT5A 5HT5A Human 5-Hydroxytryptamine A pKi 5.6 5.62 5.65 ChEMBL
5-HT1B 5HT1B Human 5-Hydroxytryptamine A pKi 5.66 5.68 5.7 ChEMBL
5-HT1D 5HT1D Human 5-Hydroxytryptamine A pKi 5.51 5.53 5.55 ChEMBL
α1D ADA1D Human Adrenoceptors A pKi 5.84 5.84 5.84 ChEMBL
α2B ADA2B Human Adrenoceptors A pKi 5.78 5.78 5.79 ChEMBL
H2 HRH2 Human Histamine A pKi 5.76 5.78 5.79 ChEMBL
H1 HRH1 Human Histamine A pKi 5.72 5.77 5.88 ChEMBL
α1A ADA1A Human Adrenoceptors A pKi 5.78 5.84 5.87 ChEMBL
α2A ADA2A Human Adrenoceptors A pKi 5.58 5.58 5.58 ChEMBL
D1 DRD1 Human Dopamine A pKi 5.83 5.85 5.89 ChEMBL
5-HT2C 5HT2C Human 5-Hydroxytryptamine A pKi 5.97 5.97 5.98 ChEMBL
M1 ACM1 Human Acetylcholine (muscarinic) A pKi 5.68 5.7 5.71 ChEMBL
D3 DRD3 Human Dopamine A pKi 5.65 5.67 5.72 ChEMBL
5-HT2A 5HT2A Human 5-Hydroxytryptamine A pKi 5.82 5.84 5.88 ChEMBL
5-HT1A 5HT1A Human 5-Hydroxytryptamine A pKi 5.59 5.62 5.66 ChEMBL
κ OPRK Human Opioid A pKi 6.0 6.0 6.01 ChEMBL
μ OPRM Human Opioid A pKi 5.34 5.38 5.4 ChEMBL
D2 DRD2 Human Dopamine A pKi 5.56 5.58 5.63 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database