BRL-54443


SMILES CN1CCC(CC1)c1c[nH]c2c1cc(O)cc2
InChIKey WKNFADCGOAHBPG-UHFFFAOYSA-N

Chemical properties

Hydrogen bond acceptors 2
Hydrogen bond donors 2
Rotatable bonds 1
Molecular weight (Da) 230.1

Drug properties

Molecular type Small molecule
Endogenous/Surrogate Surrogate
Approved drug No

Database connections

Structure pdb 7E33
Ligand site mutations 5-HT1A 5-HT1E

Bioactivities

Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
DP1 PD2R Human Prostanoid A pIC50 7.46 7.93 8.4 ChEMBL
DP1 PD2R Human Prostanoid A pIC50 8.4 8.4 8.4 Guide to Pharmacology
DP2 PD2R2 Human Prostanoid A pIC50 8.1 8.31 8.52 ChEMBL
DP2 PD2R2 Human Prostanoid A pIC50 8.52 8.52 8.52 Guide to Pharmacology