| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 8th, 2004 | 19 | 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) | 3.83 | 7.46 | -9.65 | 4 | 6 | 0 | 93 | 295.133 | 2 | ↓ |
| Lo Low (pH 4.5-6) | 3.83 | 7.75 | -31.85 | 5 | 6 | 1 | 94 | 296.141 | 2 | ↓ |
| Lo Low (pH 4.5-6) | 3.83 | 3.08 | -28.52 | 5 | 6 | 1 | 94 | 296.141 | 2 | ↓ |
| Code | Description | Organism Class | Affinity (nM) | LE (kcal/mol/atom) | Type |
|---|---|---|---|---|---|
| PRIM-1-V | DNA Helicase/primase Complex Protein (cluster #1 Of 1), Viral | Viruses | 920 | 0.44 | Binding ≤ 10μM |
| Z50530-3-O | Human Herpesvirus 5 (cluster #3 Of 5), Other | Other | 8000 | 0.38 | Functional ≤ 10μM |
| Z80942-1-O | HEL (Embryonic Lung Cells) (cluster #1 Of 2), Other | Other | 8000 | 0.38 | Functional ≤ 10μM |
| Uniprot | Swissprot | Description | Affinity (nM) | LE (kcal/mol/atom) | Type |
|---|---|---|---|---|---|
| PRIM_HHV11 | P10236 | DNA Helicase/primase Complex Protein, Hhv11 | 920 | 0.44 | Binding ≤ 1μM |
| PRIM_HHV11 | P10236 | DNA Helicase/primase Complex Protein, Hhv11 | 920 | 0.44 | Binding ≤ 10μM |
| Z80942 | Z80942 | HEL (Embryonic Lung Cells) | 5000 | 0.39 | Functional ≤ 10μM |
| Z50530 | Z50530 | Human Herpesvirus 5 | 8000 | 0.38 | Functional ≤ 10μM |
No pre-computed analogs available. Try a structural similarity search.
