ISOLOXAPINE
SMILES | CN1CCN(C2=Nc3cc(Cl)ccc3Oc3ccccc32)CC1 |
InChIKey | AWHNHDGHHNGACT-UHFFFAOYSA-N |
Chemical properties
Hydrogen bond acceptors | 4 |
Hydrogen bond donors | 0 |
Rotatable bonds | 0 |
Molecular weight (Da) | 327.1 |
Drug properties
Molecular type | Small molecule |
Endogenous/Surrogate | Surrogate |
Approved drug | No |
Database connections
Ligand site mutations | H4 |
Bioactivities
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
H4 | HRH4 | Human | Histamine | A | pKi | 7.37 | 7.37 | 7.37 | ChEMBL |
D2 | DRD2 | Human | Dopamine | A | pKi | 6.82 | 6.82 | 6.82 | ChEMBL |
D4 | DRD4 | Human | Dopamine | A | pKi | 7.64 | 7.64 | 7.64 | ChEMBL |
5-HT2C | 5HT2C | Rat | 5-Hydroxytryptamine | A | pKi | 7.72 | 7.72 | 7.72 | ChEMBL |
D2 | DRD2 | Rat | Dopamine | A | pKi | 6.82 | 6.82 | 6.82 | ChEMBL |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
H4 | HRH4 | Human | Histamine | A | pEC50 | 7.55 | 7.55 | 7.55 | ChEMBL |