U46619
| SMILES | CCCCC[C@@H](/C=C/[C@H]1[C@@H]2OC[C@H]([C@@H]1C/C=C\CCCC(=O)O)C2)O |
| InChIKey | LQANGKSBLPMBTJ-BRSNVKEHSA-N |
Chemical properties
| Hydrogen bond acceptors | 3 |
| Hydrogen bond donors | 2 |
| Rotatable bonds | 12 |
| Molecular weight (Da) | 350.2 |
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 |
| TP | TA2R | Human | Prostanoid | A | pKd | 7.8 | 7.8 | 7.8 | Guide to Pharmacology |
| TP | TA2R | Human | Prostanoid | A | pKi | 7.5 | 7.5 | 7.5 | Guide to Pharmacology |
| DP2 | PD2R2 | Human | Prostanoid | A | pKi | 5.5 | 5.5 | 5.5 | Guide to Pharmacology |
| EP1 | PE2R1 | Human | Prostanoid | A | pKi | 4.5 | 4.5 | 4.5 | Guide to Pharmacology |
| EP2 | PE2R2 | Human | Prostanoid | A | pKi | 4.9 | 4.9 | 4.9 | Guide to Pharmacology |
| EP3 | PE2R3 | Human | Prostanoid | A | pKi | 4.9 | 4.9 | 4.9 | Guide to Pharmacology |
| EP4 | PE2R4 | Human | Prostanoid | A | pKi | 5.7 | 5.7 | 5.7 | Guide to Pharmacology |
| FP | PF2R | Human | Prostanoid | A | pKi | 6.6 | 6.6 | 6.6 | Guide to Pharmacology |
| TP | TA2R | Mouse | Prostanoid | A | pKi | 7.2 | 7.2 | 7.2 | Guide to Pharmacology |
| EP3 | PE2R3 | Rat | Prostanoid | A | pKi | 4.79 | 4.79 | 4.79 | Guide to Pharmacology |
| EP1 | PE2R1 | Rat | Prostanoid | A | pKi | 5.2 | 5.2 | 5.2 | Guide to Pharmacology |
| FP | PF2R | Mouse | Prostanoid | A | pKi | 6.0 | 6.0 | 6.0 | Guide to Pharmacology |
| EP2 | PE2R2 | Rat | Prostanoid | A | pKi | 5.1 | 5.1 | 5.1 | Guide to Pharmacology |
| EP4 | PE2R4 | Rat | Prostanoid | A | pKi | 5.6 | 5.6 | 5.6 | Guide to Pharmacology |
| TP | TA2R | Human | Prostanoid | A | pKi | 8.26 | 8.26 | 8.26 | ChEMBL |
| TP | TA2R | Human | Prostanoid | A | pKi | 7.09 | 7.48 | 8.44 | PDSP Ki database |
| EP3 | PE2R3 | Bovine | Prostanoid | A | pKi | 5.0 | 5.0 | 5.0 | PDSP Ki database |
| FP | PF2R | Bovine | Prostanoid | A | pKi | 5.05 | 5.05 | 5.05 | PDSP Ki database |
| EP1 | PE2R1 | Human | Prostanoid | A | pKi | 5.0 | 5.0 | 5.0 | PDSP Ki database |
| EP3 | PE2R3 | Human | Prostanoid | A | pKi | 5.0 | 5.0 | 5.0 | PDSP Ki database |
| DP1 | PD2R | Human | Prostanoid | A | pKi | 5.4 | 5.4 | 5.4 | PDSP Ki database |
| EP4 | PE2R4 | Human | Prostanoid | A | pKi | 5.0 | 5.35 | 5.7 | PDSP Ki database |
| FP | PF2R | Human | Prostanoid | A | pKi | 6.62 | 6.62 | 6.62 | PDSP Ki database |
| IP | PI2R | Human | Prostanoid | A | pKi | 5.0 | 5.0 | 5.0 | PDSP Ki database |
| DP1 | PD2R | Human | Prostanoid | A | pKi | 5.4 | 5.65 | 5.9 | Guide to Pharmacology |
| IP | PI2R | Human | Prostanoid | A | pKi | 4.2 | 4.2 | 4.2 | Guide to Pharmacology |
| FP | PF2R | Mouse | Prostanoid | A | pKi | 6.0 | 6.0 | 6.0 | PDSP Ki database |
| Receptor | Activity | Source | |||||||
|---|---|---|---|---|---|---|---|---|---|
| GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
| EP3 | PE2R3 | Rat | Prostanoid | A | pEC50 | 6.83 | 6.83 | 6.83 | Guide to Pharmacology |