CHEMBL4869194
SMILES | Cc1ccc(C(C)NC(=O)/N=C(\N)NCCCc2sc(N)nc2C)cc1 |
InChIKey | LIBHXUIZGKHXII-UHFFFAOYSA-N |
Chemical properties
Hydrogen bond acceptors | 4 |
Hydrogen bond donors | 4 |
Rotatable bonds | 6 |
Molecular weight (Da) | 374.2 |
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 |
H4 | HRH4 | Human | Histamine | A | pKi | 4.95 | 4.95 | 4.95 | ChEMBL |
H2 | HRH2 | Human | Histamine | A | pKi | 7.51 | 7.51 | 7.51 | ChEMBL |
H1 | HRH1 | Human | Histamine | A | pKi | 5.29 | 5.29 | 5.29 | ChEMBL |
H3 | HRH3 | Human | Histamine | A | pKi | 4.58 | 4.58 | 4.58 | ChEMBL |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |