CHEMBL105515
SMILES | CC1CCCC(C)N1CCCOc1ccc(-c2ccc(C#N)cc2)cc1 |
InChIKey | RGULNTQENHHTRC-UHFFFAOYSA-N |
Chemical properties
Hydrogen bond acceptors | 3 |
Hydrogen bond donors | 0 |
Rotatable bonds | 6 |
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 |
H3 | HRH3 | Rat | Histamine | A | pKi | 7.79 | 7.79 | 7.79 | ChEMBL |
H2 | HRH2 | Human | Histamine | A | pKi | 4.62 | 4.62 | 4.62 | ChEMBL |
H1 | HRH1 | Human | Histamine | A | pKi | 5.4 | 5.4 | 5.4 | ChEMBL |
H3 | HRH3 | Human | Histamine | A | pKi | 8.67 | 8.67 | 8.67 | ChEMBL |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |