| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| March 5th, 2009 | 31 | Yes |
Popular Name: 1-(benzyloxymethyl)-5-ethyl-6-(naphthalene-1-carbonyl)pyrimidine-2,4-dione 1-(benzyloxymethyl)-5-ethyl-6-(n…
| 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) | 4.65 | 10.02 | -12.03 | 1 | 6 | 0 | 81 | 414.461 | 7 | ↓ |
| Mid Mid (pH 6-8) | 5.11 | 8.23 | -56.39 | 0 | 6 | -1 | 84 | 413.453 | 7 | ↓ |
| Code | Description | Organism Class | Affinity (nM) | LE (kcal/mol/atom) | Type |
|---|---|---|---|---|---|
| Z50607-1-O | Human Immunodeficiency Virus 1 (cluster #1 Of 10), Other | Other | 150 | 0.31 | Functional ≤ 10μM |
| Uniprot | Swissprot | Description | Affinity (nM) | LE (kcal/mol/atom) | Type |
|---|---|---|---|---|---|
| Z50607 | Z50607 | Human Immunodeficiency Virus 1 | 150 | 0.31 | Functional ≤ 10μM |
