| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 26th, 2009 | 35 | 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) | 5.63 | 12.88 | -46 | 1 | 6 | 1 | 59 | 480.617 | 5 | ↓ |
| Code | Description | Organism Class | Affinity (nM) | LE (kcal/mol/atom) | Type |
|---|---|---|---|---|---|
| ADK-1-E | Adenosine Kinase (cluster #1 Of 1), Eukaryotic | Eukaryotes | 90 | 0.28 | Binding ≤ 10μM |
| Uniprot | Swissprot | Description | Affinity (nM) | LE (kcal/mol/atom) | Type |
|---|---|---|---|---|---|
| ADK_HUMAN | P55263 | Adenosine Kinase, Human | 90 | 0.28 | Binding ≤ 1μM |
| ADK_HUMAN | P55263 | Adenosine Kinase, Human | 90 | 0.28 | Binding ≤ 10μM |
| Description | Species |
|---|---|
| Purine salvage |
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