ILOPROST
| SMILES | CC#CCC(C)C(C=CC1C(CC2C1CC(=CCCCC(=O)O)C2)O)O |
| InChIKey | HIFJCPQKFCZDDL-UHFFFAOYSA-N |
Chemical properties
| Hydrogen bond acceptors | 3 |
| Hydrogen bond donors | 3 |
| Rotatable bonds | 8 |
| Molecular weight (Da) | 360.2 |
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 |
| EP1 | PE2R1 | Mouse | Prostanoid | A | pKi | 7.68 | 7.68 | 7.68 | PDSP Ki database |
| EP3 | PE2R3 | Mouse | Prostanoid | A | pKi | 7.66 | 7.66 | 7.66 | PDSP Ki database |
| EP4 | PE2R4 | Mouse | Prostanoid | A | pKi | 5.64 | 5.64 | 5.64 | PDSP Ki database |
| IP | PI2R | Mouse | Prostanoid | A | pKi | 7.96 | 7.96 | 7.96 | PDSP Ki database |
| EP2 | PE2R2 | Mouse | Prostanoid | A | pKi | 5.8 | 5.8 | 5.8 | PDSP Ki database |
| EP3 | PE2R3 | Bovine | Prostanoid | A | pKi | 6.58 | 6.58 | 6.58 | PDSP Ki database |
| EP1 | PE2R1 | Human | Prostanoid | A | pKi | 7.96 | 7.96 | 7.96 | PDSP Ki database |
| EP4 | PE2R4 | Human | Prostanoid | A | pKi | 5.73 | 6.14 | 6.55 | PDSP Ki database |
| DP1 | PD2R | Human | Prostanoid | A | pKi | 5.99 | 5.99 | 5.99 | PDSP Ki database |
| EP3 | PE2R3 | Human | Prostanoid | A | pKi | 7.25 | 7.25 | 7.25 | PDSP Ki database |
| FP | PF2R | Human | Prostanoid | A | pKi | 6.21 | 6.21 | 6.21 | PDSP Ki database |
| IP | PI2R | Human | Prostanoid | A | pKi | 7.96 | 7.96 | 7.96 | PDSP Ki database |
| Receptor | Activity | Source | |||||||
|---|---|---|---|---|---|---|---|---|---|
| GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |