BODILISANT
| SMILES | CC1=CC(C)=[N+]2C1=C(c1ccc(OCCCN3CCCCC3)cc1)c1c(C)cc(C)n1[B-]2(F)F |
| InChIKey | HPRWHXGAJGUOCP-UHFFFAOYSA-N |
Chemical properties
| Hydrogen bond acceptors | 3 |
| Hydrogen bond donors | 0 |
| Rotatable bonds | 6 |
| Molecular weight (Da) | 465.3 |
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 |
| D5 | DRD5 | Human | Dopamine | A | pKi | 5.28 | 5.28 | 5.28 | ChEMBL |
| H4 | HRH4 | Human | Histamine | A | pKi | 5.13 | 5.13 | 5.13 | ChEMBL |
| H1 | HRH1 | Human | Histamine | A | pKi | 5.78 | 5.78 | 5.78 | ChEMBL |
| D1 | DRD1 | Human | Dopamine | A | pKi | 4.9 | 4.9 | 4.9 | ChEMBL |
| H3 | HRH3 | Human | Histamine | A | pKi | 8.19 | 8.19 | 8.19 | ChEMBL |
| D3 | DRD3 | Human | Dopamine | A | pKi | 5.83 | 5.83 | 5.83 | ChEMBL |
| D2 | DRD2 | Human | Dopamine | A | pKi | 5.71 | 5.71 | 5.71 | ChEMBL |
| Receptor | Activity | Source | |||||||
|---|---|---|---|---|---|---|---|---|---|
| GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |