CHEMBL102416
SMILES | N#Cc1ccc(-c2ccc(OCCCN3CCC(O)CC3)cc2)cc1 |
InChIKey | CRGOWMIZBWIMTB-UHFFFAOYSA-N |
Chemical properties
Hydrogen bond acceptors | 4 |
Hydrogen bond donors | 1 |
Rotatable bonds | 6 |
Molecular weight (Da) | 336.2 |
Drug properties
Molecular type | Small molecule |
Physiological/Surrogate | Surrogate |
Approved drug | No |
Database connections
Sankey plot
Compound is not listed as a drug.
Bioactivities
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
H3 | HRH3 | Rat | Histamine | A | pKi | 7.5 | 7.5 | 7.5 | ChEMBL |
H2 | HRH2 | Human | Histamine | A | pKi | 5.0 | 5.0 | 5.0 | ChEMBL |
H1 | HRH1 | Human | Histamine | A | pKi | 6.24 | 6.24 | 6.24 | ChEMBL |
H3 | HRH3 | Human | Histamine | A | pKi | 6.91 | 6.91 | 6.91 | ChEMBL |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |