CHEMBL566075


SMILES Cc1cnc(N[C@H]2CC[C@@H](CNC(=O)c3cc(C(F)(F)F)cc(C(F)(F)F)c3)CC2)nc1N(C)C
InChIKey OOUPDYBXVFKJRL-UJKQEGAGSA-N

Chemical properties

Hydrogen bond acceptors 5
Hydrogen bond donors 2
Rotatable bonds 6
Molecular weight (Da) 503.2

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
α1A ADA1A Human Adrenoceptors A pIC50 5.5 5.5 5.5 ChEMBL
MCH1 MCHR1 Human Melanin-concentrating hormone A pIC50 8.3 8.3 8.3 ChEMBL
α2A ADA2A Human Adrenoceptors A pIC50 6.51 6.51 6.51 ChEMBL
5-HT2B 5HT2B Human 5-Hydroxytryptamine A pIC50 5.51 5.51 5.51 ChEMBL
5-HT1A 5HT1A Human 5-Hydroxytryptamine A pIC50 5.32 5.32 5.32 ChEMBL