| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 8th, 2008 | 25 | Yes |
Popular Name: 5-cis Carbaprostacyclin 5-cis Carbaprostacyclin
| 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) | 4.14 | -2.53 | -49.28 | 2 | 4 | -1 | 81 | 349.491 | 10 | ↓ |
| Code | Description | Organism Class | Affinity (nM) | LE (kcal/mol/atom) | Type |
|---|---|---|---|---|---|
| PPARA-2-E | Peroxisome Proliferator-activated Receptor Alpha (cluster #2 Of 3), Eukaryotic | Eukaryotes | 960 | 0.34 | Binding ≤ 10μM |
| PPARD-1-E | Peroxisome Proliferator-activated Receptor Delta (cluster #1 Of 2), Eukaryotic | Eukaryotes | 1880 | 0.32 | Binding ≤ 10μM |
| PPARG-2-E | Peroxisome Proliferator-activated Receptor Gamma (cluster #2 Of 2), Eukaryotic | Eukaryotes | 7910 | 0.29 | Binding ≤ 10μM |
| PPARA-2-E | Peroxisome Proliferator-activated Receptor Alpha (cluster #2 Of 2), Eukaryotic | Eukaryotes | 340 | 0.36 | Functional ≤ 10μM |
| PPARD-2-E | Peroxisome Proliferator-activated Receptor Delta (cluster #2 Of 2), Eukaryotic | Eukaryotes | 2410 | 0.31 | Functional ≤ 10μM |
| Uniprot | Swissprot | Description | Affinity (nM) | LE (kcal/mol/atom) | Type |
|---|---|---|---|---|---|
| PPARA_HUMAN | Q07869 | Peroxisome Proliferator-activated Receptor Alpha, Human | 960 | 0.34 | Binding ≤ 1μM |
| PPARA_HUMAN | Q07869 | Peroxisome Proliferator-activated Receptor Alpha, Human | 960 | 0.34 | Binding ≤ 10μM |
| PPARD_HUMAN | Q03181 | Peroxisome Proliferator-activated Receptor Delta, Human | 1880 | 0.32 | Binding ≤ 10μM |
| PPARG_HUMAN | P37231 | Peroxisome Proliferator-activated Receptor Gamma, Human | 7910 | 0.29 | Binding ≤ 10μM |
| PPARA_HUMAN | Q07869 | Peroxisome Proliferator-activated Receptor Alpha, Human | 340 | 0.36 | Functional ≤ 10μM |
| PPARD_HUMAN | Q03181 | Peroxisome Proliferator-activated Receptor Delta, Human | 2410 | 0.31 | Functional ≤ 10μM |
