ROXATIDINE ACETATE
SMILES | CC(=O)OCC(=O)NCCCOc1cccc(CN2CCCCC2)c1 |
InChIKey | SMTZFNFIKUPEJC-UHFFFAOYSA-N |
Chemical properties
Hydrogen bond acceptors | 5 |
Hydrogen bond donors | 1 |
Rotatable bonds | 9 |
Molecular weight (Da) | 348.2 |
Drug properties
Molecular type | Small molecule |
Physiological/Surrogate | Surrogate |
Approved drug | No |
Database connections
Bioactivities
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
H2 | HRH2 | Human | Histamine | A | pKd | 6.6 | 6.6 | 6.6 | ChEMBL |
H2 | HRH2 | Human | Histamine | A | pKd | 8.12 | 8.12 | 8.12 | Drug Central |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |