CHEMBL3916247


SMILES O=C(Nc1ccc(C2CNCCO2)cc1)c1ccc(Oc2ccc(C(=O)O)c(Cl)c2)cc1
InChIKey NMPBETGMQHPGMS-UHFFFAOYSA-N

Chemical properties

Hydrogen bond acceptors 5
Hydrogen bond donors 3
Rotatable bonds 6
Molecular weight (Da) 452.1

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 Rat Trace amine A pKi 5.64 5.64 5.64 ChEMBL
TA1 TAAR1 Mouse Trace amine A pKi 5.55 5.55 5.55 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database