CHEMBL1091874
SMILES | CN[C@@H]1CCN(c2nc(N)nc3c2oc2ccc(Cl)cc23)C1 |
InChIKey | POXFWGOYGQTRMD-SECBINFHSA-N |
Chemical properties
Hydrogen bond acceptors | 6 |
Hydrogen bond donors | 2 |
Rotatable bonds | 2 |
Molecular weight (Da) | 317.1 |
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 |
H4 | HRH4 | Human | Histamine | A | pKi | 9.4 | 9.4 | 9.4 | ChEMBL |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
H4 | HRH4 | Human | Histamine | A | pIC50 | 8.52 | 8.76 | 9.0 | ChEMBL |
H3 | HRH3 | Human | Histamine | A | pIC50 | 5.24 | 5.24 | 5.24 | ChEMBL |