| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 3rd, 2008 | 20 | No |
| 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) | 6.82 | 9.87 | -32.4 | 3 | 2 | 1 | 37 | 286.524 | 16 | ↓ |
| Code | Description | Organism Class | Affinity (nM) | LE (kcal/mol/atom) | Type |
|---|---|---|---|---|---|
| PA21B-1-E | Phospholipase A2 Group 1B (cluster #1 Of 3), Eukaryotic | Eukaryotes | 6200 | 0.36 | Binding ≤ 10μM |
| PA2GA-2-E | Phospholipase A2, Membrane Associated (cluster #2 Of 3), Eukaryotic | Eukaryotes | 3700 | 0.38 | Binding ≤ 10μM |
| Q6UB75-1-E | Group VII Phospholipase A2 (cluster #1 Of 2), Eukaryotic | Eukaryotes | 1400 | 0.41 | Binding ≤ 10μM |
| Z81072-7-O | Jurkat (Acute Leukemic T-cells) (cluster #7 Of 10), Other | Other | 6000 | 0.37 | Functional ≤ 10μM |
| Uniprot | Swissprot | Description | Affinity (nM) | LE (kcal/mol/atom) | Type |
|---|---|---|---|---|---|
| Q6UB75_PIG | Q6UB75 | Group VII Phospholipase A2, Pig | 1400 | 0.41 | Binding ≤ 10μM |
| PA21B_HUMAN | P04054 | Phospholipase A2 Group 1B, Human | 6100 | 0.37 | Binding ≤ 10μM |
| PA2GA_HUMAN | P14555 | Phospholipase A2 Group IIA, Human | 3700 | 0.38 | Binding ≤ 10μM |
| Z81072 | Z81072 | Jurkat (Acute Leukemic T-cells) | 6000 | 0.37 | Functional ≤ 10μM |
| Description | Species |
|---|---|
| Acyl chain remodelling of PC | |
| Acyl chain remodelling of PE | |
| Acyl chain remodelling of PG | |
| Acyl chain remodelling of PI | |
| Acyl chain remodelling of PS | |
| Synthesis of PA |
