| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| March 5th, 2009 | 15 | No |
Popular Name: methyl methyl
| 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) | 0.99 | 3.16 | -42.22 | 0 | 5 | -1 | 76 | 209.177 | 4 | ↓ |
| Mid Mid (pH 6-8) | 0.99 | 2.36 | -15.59 | 1 | 5 | 0 | 73 | 210.185 | 4 | ↓ |
| Code | Description | Organism Class | Affinity (nM) | LE (kcal/mol/atom) | Type |
|---|---|---|---|---|---|
| Z50185-2-O | Staphylococcus Aureus (cluster #2 Of 4), Other | Other | 4760 | 0.50 | Functional ≤ 10μM |
| Z50186-1-O | Staphylococcus Epidermidis (cluster #1 Of 2), Other | Other | 2380 | 0.52 | Functional ≤ 10μM |
| Uniprot | Swissprot | Description | Affinity (nM) | LE (kcal/mol/atom) | Type |
|---|---|---|---|---|---|
| Z50185 | Z50185 | Staphylococcus Aureus | 4760 | 0.50 | Functional ≤ 10μM |
| Z50186 | Z50186 | Staphylococcus Epidermidis | 2380 | 0.52 | Functional ≤ 10μM |
