In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 7th, 2009 | 41 | 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) | 8.64 | 19.99 | -51.99 | 0 | 4 | -1 | 58 | 584.205 | 10 | ↓ |
Mid Mid (pH 6-8) | 8.64 | 20.33 | -72.82 | 1 | 4 | 0 | 59 | 585.213 | 10 | ↓ |
Code | Description | Organism Class | Affinity (nM) | LE (kcal/mol/atom) | Type |
---|---|---|---|---|---|
AL5AP-1-E | 5-lipoxygenase Activating Protein (cluster #1 Of 1), Eukaryotic | Eukaryotes | 16 | 0.27 | Binding ≤ 10μM |
Z50587-1-O | Homo Sapiens (cluster #1 Of 9), Other | Other | 4 | 0.29 | Functional ≤ 10μM |
Uniprot | Swissprot | Description | Affinity (nM) | LE (kcal/mol/atom) | Type |
---|---|---|---|---|---|
AL5AP_HUMAN | P20292 | 5-lipoxygenase Activating Protein, Human | 16 | 0.27 | Binding ≤ 1μM |
AL5AP_HUMAN | P20292 | 5-lipoxygenase Activating Protein, Human | 16 | 0.27 | Binding ≤ 10μM |
Z50587 | Z50587 | Homo Sapiens | 4 | 0.29 | Functional ≤ 10μM |
Description | Species |
---|---|
Synthesis of 5-eicosatetraenoic acids | |
Synthesis of Leukotrienes (LT) and Eoxins (EX) | |
Synthesis of Lipoxins (LX) |