| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| February 4th, 2009 | 28 | Yes |
| Type pH range | xlogP | Des A‑Pol Apolar desolvation (kcal/mol) | Des Pol Polar desolvation (kcal/mol) | H Don H-bond donors | H Acc H-bond acceptors | Chg Net charge | tPSA (Ų) | MWT Molecular weight (g/mol) | RB Rotatable bonds | DL |
|---|---|---|---|---|---|---|---|---|---|---|
| Ref Reference (pH 7) | 3.36 | 8.5 | -54.45 | 2 | 5 | -1 | 98 | 393.544 | 13 | ↓ |
| Lo Low (pH 4.5-6) | 3.36 | 7.38 | -13.73 | 3 | 5 | 0 | 95 | 394.552 | 13 | ↓ |
| Code | Description | Organism Class | Affinity (nM) | LE (kcal/mol/atom) | Type |
|---|---|---|---|---|---|
| PE2R2-2-E | Prostanoid EP2 Receptor (cluster #2 Of 2), Eukaryotic | Eukaryotes | 73 | 0.36 | Binding ≤ 10μM |
| PI2R-2-E | Prostanoid IP Receptor (cluster #2 Of 2), Eukaryotic | Eukaryotes | 870 | 0.30 | Binding ≤ 10μM |
| PE2R2-1-E | Prostanoid EP2 Receptor (cluster #1 Of 1), Eukaryotic | Eukaryotes | 32 | 0.37 | Functional ≤ 10μM |
| PI2R-1-E | Prostanoid IP Receptor (cluster #1 Of 1), Eukaryotic | Eukaryotes | 25 | 0.38 | Functional ≤ 10μM |
| Uniprot | Swissprot | Description | Affinity (nM) | LE (kcal/mol/atom) | Type |
|---|---|---|---|---|---|
| PE2R2_MOUSE | Q62053 | Prostanoid EP2 Receptor, Mouse | 73 | 0.36 | Binding ≤ 1μM |
| PI2R_HUMAN | P43119 | Prostanoid IP Receptor, Human | 870 | 0.30 | Binding ≤ 1μM |
| PE2R2_MOUSE | Q62053 | Prostanoid EP2 Receptor, Mouse | 73 | 0.36 | Binding ≤ 10μM |
| PI2R_HUMAN | P43119 | Prostanoid IP Receptor, Human | 870 | 0.30 | Binding ≤ 10μM |
| PE2R2_MOUSE | Q62053 | Prostanoid EP2 Receptor, Mouse | 32 | 0.37 | Functional ≤ 10μM |
| PI2R_HUMAN | P43119 | Prostanoid IP Receptor, Human | 25 | 0.38 | Functional ≤ 10μM |
| Description | Species |
|---|---|
| G alpha (s) signalling events | |
| Prostacyclin signalling through prostacyclin receptor | |
| Prostanoid ligand receptors |
