CHEMBL2206388


SMILES COc1cccc(N(Cc2cnc[nH]2)C(C)C)n1
InChIKey HXJNMJJXCIYGOW-UHFFFAOYSA-N

Chemical properties

Hydrogen bond acceptors 4
Hydrogen bond donors 1
Rotatable bonds 5
Molecular weight (Da) 246.1

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
TA1 TAAR1 Human Trace amine A pKi 7.92 7.92 7.92 ChEMBL
TA1 TAAR1 Mouse Trace amine A pKi 8.62 8.62 8.62 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
TA1 TAAR1 Rat Trace amine A pEC50 7.6 7.6 7.6 ChEMBL
TA1 TAAR1 Human Trace amine A pEC50 7.4 7.4 7.4 ChEMBL
TA1 TAAR1 Mouse Trace amine A pEC50 7.01 7.01 7.01 ChEMBL