CHEMBL78838
SMILES | c1cncc(Cc2c[nH]cn2)c1 |
InChIKey | IQMRECYOUIKYGG-UHFFFAOYSA-N |
Chemical properties
Hydrogen bond acceptors | 2 |
Hydrogen bond donors | 1 |
Rotatable bonds | 2 |
Molecular weight (Da) | 159.1 |
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 | 6.16 | 6.58 | 7.0 | ChEMBL |
H3 | HRH3 | Human | Histamine | A | pKi | 7.12 | 7.2 | 7.28 | ChEMBL |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
H4 | HRH4 | Human | Histamine | A | pEC50 | 4.82 | 4.82 | 4.82 | ChEMBL |
H3 | HRH3 | Human | Histamine | A | pEC50 | 6.85 | 7.13 | 7.41 | ChEMBL |