| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 10th, 2010 | 19 | Yes |
Popular Name: (1R,2R,3S,4S,5S)-5-(6-chloropurin-9-yl)norbornane-2,3-diol (1R,2R,3S,4S,5S)-5-(6-chloropuri…
| 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) | 0.39 | 3.07 | -11.56 | 2 | 6 | 0 | 84 | 280.715 | 1 | ↓ |
| Code | Description | Organism Class | Affinity (nM) | LE (kcal/mol/atom) | Type |
|---|---|---|---|---|---|
| Z50617-1-O | Human Coxsackievirus B3 (cluster #1 Of 2), Other | Other | 2260 | 0.42 | Functional ≤ 10μM |
| Uniprot | Swissprot | Description | Affinity (nM) | LE (kcal/mol/atom) | Type |
|---|---|---|---|---|---|
| Z50617 | Z50617 | Human Coxsackievirus B3 | 2260 | 0.42 | Functional ≤ 10μM |
