CHEMBL3286557


SMILES CNc1nc(C(F)(F)c2ccccc2)nc2c1CCNCC2
InChIKey XYHWHDGNYCZFTQ-UHFFFAOYSA-N

Chemical properties

Hydrogen bond acceptors 4
Hydrogen bond donors 2
Rotatable bonds 3
Molecular weight (Da) 304.2

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
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
5-HT1B 5HT1B Human 5-Hydroxytryptamine A pIC50 6.21 6.21 6.21 ChEMBL
5-HT2B 5HT2B Human 5-Hydroxytryptamine A pIC50 6.96 6.96 6.96 ChEMBL
5-HT2C 5HT2C Human 5-Hydroxytryptamine A pEC50 7.8 7.8 7.8 ChEMBL
β2 ADRB2 Human Adrenoceptors A pIC50 5.85 5.85 5.85 ChEMBL
5-HT2A 5HT2A Human 5-Hydroxytryptamine A pIC50 6.92 6.92 6.92 ChEMBL