CHEMBL1789801
SMILES | O=C(NCCCC1CCCCC1)OCCCc1c[nH]cn1 |
InChIKey | QFOKEUVZRMQKAH-UHFFFAOYSA-N |
Chemical properties
Hydrogen bond acceptors | 3 |
Hydrogen bond donors | 2 |
Rotatable bonds | 8 |
Molecular weight (Da) | 293.2 |
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 |
H1 | HRH1 | Guinea pig | Histamine | A | pKd | 4.97 | 4.97 | 4.97 | ChEMBL |
H4 | HRH4 | Human | Histamine | A | pKi | 5.35 | 5.85 | 6.35 | ChEMBL |
H3 | HRH3 | Human | Histamine | A | pKi | 6.07 | 6.57 | 7.07 | ChEMBL |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
H3 | HRH3 | Guinea pig | Histamine | A | pIC50 | 7.37 | 7.37 | 7.37 | ChEMBL |