LYSOPHOSPHATIDIC ACID
| SMILES | CCCCCCCC/C=C\CCCCCCCC(=O)OC[C@@H](O)COP(=O)(O)O |
| InChIKey | WRGQSWVCFNIUNZ-GDCKJWNLSA-N |
Chemical properties
| Hydrogen bond acceptors | 5 |
| Hydrogen bond donors | 3 |
| Rotatable bonds | 20 |
| Molecular weight (Da) | 436.3 |
Drug properties
| Molecular type | Small molecule |
| Physiological/Surrogate | Surrogate |
| Approved drug | No |
Bioactivities
| Receptor | Activity | Source | |||||||
|---|---|---|---|---|---|---|---|---|---|
| GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
| LPA1 | LPAR1 | Human | Lysophospholipid (LPA) | A | pKd | 8.25 | 8.25 | 8.25 | ChEMBL |
| Receptor | Activity | Source | |||||||
|---|---|---|---|---|---|---|---|---|---|
| GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
| LPA4 | LPAR4 | Human | Lysophospholipid (LPA) | A | pEC50 | 8.09 | 8.09 | 8.09 | ChEMBL |
| LPA2 | LPAR2 | Human | Lysophospholipid (LPA) | A | pEC50 | 7.54 | 7.99 | 8.7 | ChEMBL |
| LPA3 | LPAR3 | Human | Lysophospholipid (LPA) | A | pEC50 | 6.08 | 6.76 | 7.11 | ChEMBL |
| LPA1 | LPAR1 | Human | Lysophospholipid (LPA) | A | pEC50 | 6.08 | 7.14 | 7.77 | ChEMBL |
| LPA5 | LPAR5 | Human | Lysophospholipid (LPA) | A | pEC50 | 6.29 | 7.18 | 7.92 | ChEMBL |
| LPA6 | LPAR6 | Human | Lysophospholipid (LPA) | A | pEC50 | 6.01 | 6.01 | 6.01 | ChEMBL |
| LPA4 | LPAR4 | Mouse | Lysophospholipid (LPA) | A | pEC50 | 6.58 | 6.58 | 6.58 | ChEMBL |