amitriptyline
SMILES | CN(CCC=C1c2ccccc2CCc2c1cccc2)C |
InChIKey | KRMDCWKBEZIMAB-UHFFFAOYSA-N |
Chemical properties
Hydrogen bond acceptors | 1 |
Hydrogen bond donors | 0 |
Rotatable bonds | 3 |
Molecular weight (Da) | 277.2 |
Drug properties
Molecular type | Small molecule |
Endogenous/Surrogate | Surrogate |
Approved drug | Yes |
Database connections
Ligand site mutations | 5-HT6 |
Bioactivities
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
RXFP1 | RXFP1 | Human | Relaxin family peptide | A | pKd | 6.99 | 6.99 | 6.99 | Guide to Pharmacology |
RXFP2 | RXFP2 | Human | Relaxin family peptide | A | pKi | 6.0 | 6.0 | 6.0 | Guide to Pharmacology |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
RXFP1 | RXFP1 | Human | Relaxin family peptide | A | pEC50 | 8.22 | 8.22 | 8.22 | Guide to Pharmacology |
RXFP2 | RXFP2 | Human | Relaxin family peptide | A | pEC50 | 6.0 | 6.0 | 6.0 | Guide to Pharmacology |