CHEMBL3680111


SMILES COc1ccc(S(=O)(=O)N2CCC3(CCN(c4ccc(N5CC[C@H](N6CCC[C@@H]6C)C5)cc4C(F)(F)F)C3=O)CC2)cc1
InChIKey NHSTXELYWXZEQB-UPVQGACJSA-N

Chemical properties

Hydrogen bond acceptors 6
Hydrogen bond donors 0
Rotatable bonds 6
Molecular weight (Da) 620.3

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
H3 Q865E1 Rhesus macaque Histamine A pKi 7.97 7.97 7.97 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database