CHEMBL30713


SMILES CC(N)Cc1c[nH]c2ccccc12
InChIKey QSQQQURBVYWZKJ-UHFFFAOYSA-N

Chemical properties

Hydrogen bond acceptors 1
Hydrogen bond donors 2
Rotatable bonds 2
Molecular weight (Da) 174.1

Drug properties

Molecular type Small molecule
Physiological/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 5.72 5.72 5.72 ChEMBL
5-HT1B 5HT1B Human 5-Hydroxytryptamine A pKi 6.25 6.28 6.3 ChEMBL
5-HT1D 5HT1D Human 5-Hydroxytryptamine A pKi 5.7 5.72 5.75 ChEMBL
5-HT7 5HT7R Human 5-Hydroxytryptamine A pKi 6.99 6.99 6.99 ChEMBL
β1 ADRB1 Human Adrenoceptors A pKi 5.42 5.42 5.42 ChEMBL
5-HT1A 5HT1A Rat 5-Hydroxytryptamine A pKi 6.28 6.28 6.28 ChEMBL
5-HT6 5HT6R Human 5-Hydroxytryptamine A pKi 6.04 6.04 6.04 ChEMBL
5-HT2C 5HT2C Human 5-Hydroxytryptamine A pKi 6.78 6.78 6.78 ChEMBL
5-HT2A 5HT2A Human 5-Hydroxytryptamine A pKi 6.41 6.41 6.41 ChEMBL
5-HT1A 5HT1A Human 5-Hydroxytryptamine A pKi 5.49 5.5 5.5 ChEMBL
5-HT2A 5HT2A Bovine 5-Hydroxytryptamine A pKi 5.46 5.75 6.05 PDSP Ki database
α2A ADA2A Human Adrenoceptors A pKi 6.2 6.2 6.2 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
5-HT2B 5HT2B Human 5-Hydroxytryptamine A pEC50 7.12 7.12 7.12 ChEMBL
5-HT2C 5HT2C Human 5-Hydroxytryptamine A pEC50 6.97 6.97 6.97 ChEMBL
5-HT2A 5HT2A Human 5-Hydroxytryptamine A pEC50 7.64 7.69 7.72 ChEMBL