CHEMBL1563483
| SMILES | CCCCS(=O)(=O)/C=C\C=C/S(=O)(=O)CCCC |
| InChIKey | AWAPBXGSDGWNHK-OXAWKVHCSA-N |
Chemical properties
| Hydrogen bond acceptors | 4 |
| Hydrogen bond donors | 0 |
| Rotatable bonds | 9 |
| Molecular weight (Da) | 294.1 |
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 |
| Receptor | Activity | Source | |||||||
|---|---|---|---|---|---|---|---|---|---|
| GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
| S1P4 | S1PR4 | Human | Lysophospholipid (S1P) | A | pIC50 | 5.89 | 5.89 | 5.89 | ChEMBL |
| S1P2 | S1PR2 | Human | Lysophospholipid (S1P) | A | pIC50 | 5.35 | 5.53 | 5.71 | ChEMBL |
| AT1 | AGTR1 | Human | Angiotensin | A | pIC50 | 5.43 | 5.43 | 5.43 | ChEMBL |
| S1P1 | S1PR1 | Human | Lysophospholipid (S1P) | A | pIC50 | 4.86 | 4.86 | 4.86 | ChEMBL |
| NPS | NPSR1 | Human | Neuropeptide S | A | Potency | 5.3 | 5.3 | 5.3 | ChEMBL |