CHEMBL2387309
SMILES | O=C(Nc1ccc(OCCCN2CCCCC2)cc1)Nc1ccc(F)cc1F |
InChIKey | YOHPTBKDVIHOCX-UHFFFAOYSA-N |
Chemical properties
Hydrogen bond acceptors | 3 |
Hydrogen bond donors | 2 |
Rotatable bonds | 7 |
Molecular weight (Da) | 389.2 |
Drug properties
Molecular type | Small molecule |
Endogenous/Surrogate | Surrogate |
Approved drug | No |
Database connections
Bioactivities
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
H3 | Q865E1 | Rhesus macaque | Histamine | A | pKi | 8.47 | 8.47 | 8.47 | ChEMBL |
H3 | HRH3 | Rat | Histamine | A | pKi | 7.48 | 7.48 | 7.48 | ChEMBL |
H3 | HRH3 | Human | Histamine | A | pKi | 7.28 | 7.28 | 7.28 | ChEMBL |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
H3 | HRH3 | Human | Histamine | A | pIC50 | 9.3 | 9.3 | 9.3 | ChEMBL |