CHEMBL137781


SMILES C[C@H]1C[C@@H](C)N1C(=O)[C@@H]1C=C2c3cccc4[nH]cc(c34)CC2N(C)C1
InChIKey DUKNIHFTDAXJON-MUIJYRPGSA-N

Chemical properties

Hydrogen bond acceptors 2
Hydrogen bond donors 1
Rotatable bonds 1
Molecular weight (Da) 335.2

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
5-HT1E 5HT1E Human 5-Hydroxytryptamine A pKi 6.7 6.7 6.7 ChEMBL
5-HT2C 5HT2C Rat 5-Hydroxytryptamine A pKi 7.64 7.64 7.64 ChEMBL
5-HT5A 5HT5A Human 5-Hydroxytryptamine A pKi 7.8 7.8 7.8 ChEMBL
D5 DRD5 Human Dopamine A pKi 6.0 6.0 6.0 ChEMBL
5-HT1D 5HT1D Human 5-Hydroxytryptamine A pKi 8.43 8.43 8.43 ChEMBL
β1 ADRB1 Human Adrenoceptors A pKi 6.4 6.4 6.4 ChEMBL
5-HT7 5HT7R Human 5-Hydroxytryptamine A pKi 7.92 7.92 7.92 ChEMBL
H1 HRH1 Human Histamine A pKi 6.3 6.3 6.3 ChEMBL
5-HT2B 5HT2B Human 5-Hydroxytryptamine A pKi 7.36 7.36 7.36 ChEMBL
D4 DRD4 Human Dopamine A pKi 7.75 7.75 7.75 ChEMBL
5-HT6 5HT6R Human 5-Hydroxytryptamine A pKi 7.89 7.89 7.89 ChEMBL
β2 ADRB2 Human Adrenoceptors A pKi 5.34 5.34 5.34 ChEMBL
5-HT1A 5HT1A Human 5-Hydroxytryptamine A pKi 8.96 8.96 8.96 ChEMBL
D3 DRD3 Human Dopamine A pKi 8.1 8.1 8.1 ChEMBL
D2 DRD2 Human Dopamine A pKi 7.22 7.22 7.22 ChEMBL
D1 DRD1 Mouse Dopamine A pKi 6.64 6.64 6.64 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database