| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| February 21st, 2009 | 26 | No |
Popular Name: [(2R,3R,5R)-5-(6-aminopurin-9-yl)-3-phosphonooxy-tetrahydrofuran-2-yl]methyl [(2R,3R,5R)-5-(6-aminopurin-9-yl…
| 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) | -2.23 | 1.67 | -354.63 | 2 | 14 | -4 | 224 | 407.172 | 6 | ↓ |
| Mid Mid (pH 6-8) | -2.23 | 0.52 | -224.11 | 3 | 14 | -3 | 221 | 408.18 | 6 | ↓ |
| Mid Mid (pH 6-8) | -2.23 | 0.52 | -221.27 | 3 | 14 | -3 | 221 | 408.18 | 6 | ↓ |
| Lo Low (pH 4.5-6) | -2.23 | -0.72 | -118.72 | 4 | 14 | -2 | 218 | 409.188 | 6 | ↓ |
| Code | Description | Organism Class | Affinity (nM) | LE (kcal/mol/atom) | Type |
|---|---|---|---|---|---|
| Z50502-1-O | Meleagris Gallopavo (cluster #1 Of 1), Other | Other | 6290 | 0.28 | Functional ≤ 10μM |
| Uniprot | Swissprot | Description | Affinity (nM) | LE (kcal/mol/atom) | Type |
|---|---|---|---|---|---|
| Z50502 | Z50502 | Meleagris Gallopavo | 6290 | 0.28 | Functional ≤ 10μM |
