In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 28th, 2008 | 21 | No |
Popular Name: 2-(hydroxymethyl)-6-(nonyloxy)tetrahydro-2H-pyran-3,4,5-triol 2-(hydroxymethyl)-6-(nonyloxy)te…
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) | 1.94 | -2.01 | -5.9 | 4 | 6 | 0 | 99 | 306.399 | 10 | ↓ |
Code | Description | Organism Class | Affinity (nM) | LE (kcal/mol/atom) | Type |
---|---|---|---|---|---|
Z101682-2-O | BK Polyomavirus (cluster #2 Of 2), Other | Other | 6350 | 0.35 | Functional ≤ 10μM |
Uniprot | Swissprot | Description | Affinity (nM) | LE (kcal/mol/atom) | Type |
---|---|---|---|---|---|
Z101682 | Z101682 | BK Polyomavirus | 6350 | 0.35 | Functional ≤ 10μM |