CHEMBL471724
SMILES | CC(C)C(=O)/N=C(\N)NCCCc1c[nH]cn1 |
InChIKey | GCEYKTZXUXSFFO-UHFFFAOYSA-N |
Chemical properties
Hydrogen bond acceptors | 2 |
Hydrogen bond donors | 3 |
Rotatable bonds | 5 |
Molecular weight (Da) | 237.2 |
Drug properties
Molecular type | Small molecule |
Physiological/Surrogate | Surrogate |
Approved drug | No |
Database connections
Sankey plot
Compound is not listed as a drug.
Bioactivities
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
H1 | HRH1 | Guinea pig | Histamine | A | pKd | 5.11 | 5.11 | 5.11 | ChEMBL |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
H4 | HRH4 | Human | Histamine | A | pEC50 | 8.43 | 8.43 | 8.43 | ChEMBL |
H2 | HRH2 | Human | Histamine | A | pEC50 | 6.96 | 6.96 | 6.96 | ChEMBL |
H1 | HRH1 | Human | Histamine | A | pEC50 | 5.59 | 5.59 | 5.59 | ChEMBL |
H3 | HRH3 | Human | Histamine | A | pEC50 | 8.85 | 8.85 | 8.85 | ChEMBL |