haloperidol


SMILES Fc1ccc(cc1)C(=O)CCCN1CCC(CC1)(O)c1ccc(cc1)Cl
InChIKey LNEPOXFFQSENCJ-UHFFFAOYSA-N

Chemical properties

Hydrogen bond acceptors 3
Hydrogen bond donors 1
Rotatable bonds 6
Molecular weight (Da) 375.1

Drug properties

Molecular type Small molecule
Endogenous/Surrogate Surrogate
Approved drug Yes

Database connections

Structure pdb 6LUQ
Ligand site mutations 5-HT2A 5-HT2C D1 D2 D3 D5

Bioactivities

Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
A1 AA1R Human Adenosine A pKi 4.48 4.48 4.48 ChEMBL
A2A AA2AR Human Adenosine A pKi 4.38 4.38 4.38 ChEMBL
A3 AA3R Human Adenosine A pKi 9.36 9.36 9.36 ChEMBL
A3 AA3R Human Adenosine A pKi 9.36 9.36 9.36 Guide to Pharmacology
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
A3 AA3R Human Adenosine A pEC50 6.82 6.82 6.82 ChEMBL