CHEMBL4872375
| SMILES | CCCCCCNC(=O)/N=C(\N)Nc1cccc(-c2csc(N)n2)c1 |
| InChIKey | LMIAIPKXPWLPGV-UHFFFAOYSA-N |
Chemical properties
| Hydrogen bond acceptors | 4 |
| Hydrogen bond donors | 4 |
| Rotatable bonds | 7 |
| Molecular weight (Da) | 360.2 |
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 |
| H4 | HRH4 | Human | Histamine | A | pKi | 5.02 | 5.02 | 5.02 | ChEMBL |
| H2 | HRH2 | Human | Histamine | A | pKi | 6.16 | 6.16 | 6.16 | ChEMBL |
| D3 | DRD3 | Human | Dopamine | A | pKi | 5.89 | 5.89 | 5.89 | ChEMBL |
| D2 | DRD2 | Human | Dopamine | A | pKi | 5.6 | 5.6 | 5.6 | ChEMBL |
| H3 | HRH3 | Human | Histamine | A | pKi | 4.96 | 4.96 | 4.96 | ChEMBL |
| Receptor | Activity | Source | |||||||
|---|---|---|---|---|---|---|---|---|---|
| GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |