UR-PG146
SMILES | O=C(NC(=NCCCc1cnc[nH]1)N)CSCc1nc[nH]c1C |
InChIKey | ZOBGKPFWPWGQOI-UHFFFAOYSA-N |
Chemical properties
Hydrogen bond acceptors | 5 |
Hydrogen bond donors | 4 |
Rotatable bonds | 8 |
Molecular weight (Da) | 335.2 |
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 | Human | Histamine | A | pKi | 4.4 | 4.4 | 4.4 | Guide to Pharmacology |
H2 | HRH2 | Human | Histamine | A | pKi | 6.0 | 6.0 | 6.0 | Guide to Pharmacology |
H1 | HRH1 | Guinea pig | Histamine | A | pKd | 5.37 | 5.37 | 5.37 | ChEMBL |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |