doxepin


SMILES CN(CC/C=C\1/c2ccccc2OCc2c1cccc2)C
InChIKey ODQWQRRAPPTVAG-GZTJUZNOSA-N

Chemical properties

Hydrogen bond acceptors 2
Hydrogen bond donors 0
Rotatable bonds 3
Molecular weight (Da) 279.2

Drug properties

Molecular type Small molecule
Endogenous/Surrogate Surrogate
Approved drug Yes

Database connections

Structure pdb 3RZE
Ligand site mutations H1

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
S1P3 S1PR3 Human Lysophospholipid (S1P) A pA2 8.5 8.5 8.5 Guide to Pharmacology
S1P1 S1PR1 Human Lysophospholipid (S1P) A pEC50 4.48 4.48 4.48 ChEMBL
S1P3 S1PR3 Human Lysophospholipid (S1P) A pEC50 6.98 6.98 6.98 ChEMBL