CHEMBL1688969
SMILES | c1nc(CCn2cc(CC3CCCCC3)nn2)c[nH]1 |
InChIKey | KUWPQNYVWRUDNF-UHFFFAOYSA-N |
Chemical properties
Hydrogen bond acceptors | 4 |
Hydrogen bond donors | 1 |
Rotatable bonds | 5 |
Molecular weight (Da) | 259.2 |
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 | 6.11 | 6.11 | 6.11 | ChEMBL |
H3 | HRH3 | Human | Histamine | A | pKi | 7.12 | 7.12 | 7.12 | ChEMBL |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
H4 | HRH4 | Human | Histamine | A | pEC50 | 6.0 | 6.57 | 6.9 | ChEMBL |
H3 | HRH3 | Human | Histamine | A | pEC50 | 6.6 | 6.6 | 6.6 | ChEMBL |