CHEMBL81644
SMILES | c1ccc(Cc2c[nH]cn2)nc1 |
InChIKey | YSOIYRCVNZBHGT-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 | 5.34 | 5.34 | 5.34 | ChEMBL |
H3 | HRH3 | Human | Histamine | A | pKi | 5.75 | 5.99 | 6.23 | ChEMBL |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
H4 | HRH4 | Human | Histamine | A | pEC50 | 4.98 | 4.98 | 4.98 | ChEMBL |
H3 | HRH3 | Human | Histamine | A | pEC50 | 5.89 | 6.05 | 6.22 | ChEMBL |