CHEMBL4596491
SMILES | CC(C)(C)CNc1nccc(N2CCCNCC2)n1 |
InChIKey | AZHUBGIQDYLZDQ-UHFFFAOYSA-N |
Chemical properties
Hydrogen bond acceptors | 5 |
Hydrogen bond donors | 2 |
Rotatable bonds | 3 |
Molecular weight (Da) | 263.2 |
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 |
H4 | HRH4 | Human | Histamine | A | pKi | 7.88 | 7.88 | 7.88 | ChEMBL |
H3 | HRH3 | Human | Histamine | A | pKi | 6.27 | 6.27 | 6.27 | ChEMBL |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
H4 | HRH4 | Mouse | Histamine | A | pEC50 | 6.45 | 6.87 | 7.29 | ChEMBL |
H4 | HRH4 | Rat | Histamine | A | pEC50 | 6.19 | 6.61 | 7.03 | ChEMBL |
H4 | HRH4 | Human | Histamine | A | pEC50 | 7.37 | 7.55 | 7.74 | ChEMBL |