CHEMBL4301606


SMILES COc1ccccc1N1CCN(CCCCCNC(=O)c2ccc(SC3=C(/C=C/C4=[N+](CCCCS(=O)(=O)[O-])c5ccccc5C4(C)C)CCC/C3=C\C=C3\N(CCCCS(=O)(=O)O)c4ccccc4C3(C)C)cc2)CC1
InChIKey LWUMSLMLDKJYQL-UHFFFAOYSA-N

Chemical properties

Hydrogen bond acceptors 11
Hydrogen bond donors 2
Rotatable bonds 24
Molecular weight (Da) 1103.5

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-HT1A 5HT1A Human 5-Hydroxytryptamine A pKi 7.18 7.18 7.18 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database