| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 19th, 2008 | 17 | No |
Popular Name: LS-193593 LS-193593
| 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) | -2.35 | -6.46 | -25.45 | 5 | 7 | 0 | 122 | 259.287 | 2 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| PUBCHEM_PATENT_ID | EP0421777A1; EP0421777B1; EP0575482A1; EP0914472A2; EP0973753A2; EP0980424A2; EP1053230A1; WO1992014743A2; WO1993023021A2; WO1996022778A1; WO1996028170A1; WO1997000679A1; WO1997009052A1; WO1997027332A1; WO1997040193A2; WO1998031375A1; WO1998045276A2; WO19 | IBM Patent Data |
| Code | Description | Organism Class | Affinity (nM) | LE (kcal/mol/atom) | Type |
|---|---|---|---|---|---|
| Z50515-2-O | Human Herpesvirus 2 (cluster #2 Of 2), Other | Other | 900 | 0.50 | Functional ≤ 10μM |
| Z50599-1-O | Cowpox Virus (cluster #1 Of 1), Other | Other | 1600 | 0.48 | Functional ≤ 10μM |
| Z50600-1-O | Vaccinia Virus (cluster #1 Of 2), Other | Other | 300 | 0.54 | Functional ≤ 10μM |
| Z80954-1-O | HFF (Foreskin Fibroblasts) (cluster #1 Of 1), Other | Other | 1000 | 0.49 | ADME/T ≤ 10μM |
| Uniprot | Swissprot | Description | Affinity (nM) | LE (kcal/mol/atom) | Type |
|---|---|---|---|---|---|
| Z50599 | Z50599 | Cowpox Virus | 1600 | 0.48 | Functional ≤ 10μM |
| Z50515 | Z50515 | Human Herpesvirus 2 | 900 | 0.50 | Functional ≤ 10μM |
| Z50600 | Z50600 | Vaccinia Virus | 300 | 0.54 | Functional ≤ 10μM |
| Z80954 | Z80954 | HFF (Foreskin Fibroblasts) | 1000 | 0.49 | ADME/T ≤ 10μM |
