fexofenadine


SMILES OC(=O)C(c1ccc(cc1)C(CCCN1CCC(CC1)C(c1ccccc1)(c1ccccc1)O)O)(C)C
InChIKey RWTNPBWLLIMQHL-UHFFFAOYSA-N

Chemical properties

Hydrogen bond acceptors 4
Hydrogen bond donors 3
Rotatable bonds 10
Molecular weight (Da) 501.3

Drug properties

Molecular type Small molecule
Physiological/Surrogate Surrogate
Approved drug Yes

Database connections

Ligand site mutations H1

Bioactivities

Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
H1 HRH1 Human Histamine A pKi 7.57 7.57 7.57 Guide to Pharmacology
H1 HRH1 Human Histamine A pKi 7.03 7.3 7.57 ChEMBL
D3 DRD3 Human Dopamine A pKi 5.63 5.63 5.63 ChEMBL
D2 DRD2 Human Dopamine A pKi 5.05 5.05 5.05 ChEMBL
H1 HRH1 Human Histamine A pKi 8.1 8.1 8.1 Drug Central
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
H1 HRH1 Human Histamine A pIC50 7.11 7.29 7.82 ChEMBL