| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 3rd, 2008 | 27 | No |
| 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) | 8.67 | 12.59 | -61.65 | 1 | 4 | -1 | 70 | 377.545 | 17 | ↓ |
| Code | Description | Organism Class | Affinity (nM) | LE (kcal/mol/atom) | Type |
|---|---|---|---|---|---|
| Z50212-1-O | Escherichia Coli (cluster #1 Of 7), Other | Other | 1500 | 0.30 | Functional ≤ 10μM |
| Z50278-1-O | Bacillus Subtilis (cluster #1 Of 2), Other | Other | 3000 | 0.29 | Functional ≤ 10μM |
| Uniprot | Swissprot | Description | Affinity (nM) | LE (kcal/mol/atom) | Type |
|---|---|---|---|---|---|
| Z50278 | Z50278 | Bacillus Subtilis | 3000 | 0.29 | Functional ≤ 10μM |
| Z50212 | Z50212 | Escherichia Coli | 1500 | 0.30 | Functional ≤ 10μM |
