| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 3rd, 2008 | 25 | No |
None
| 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) | 7.95 | 11.03 | -61.73 | 1 | 4 | -1 | 70 | 349.491 | 15 | ↓ |
| Code | Description | Organism Class | Affinity (nM) | LE (kcal/mol/atom) | Type |
|---|---|---|---|---|---|
| Z50212-1-O | Escherichia Coli (cluster #1 Of 7), Other | Other | 5000 | 0.30 | Functional ≤ 10μM |
| Z50278-1-O | Bacillus Subtilis (cluster #1 Of 2), Other | Other | 2200 | 0.32 | Functional ≤ 10μM |
| Uniprot | Swissprot | Description | Affinity (nM) | LE (kcal/mol/atom) | Type |
|---|---|---|---|---|---|
| Z50278 | Z50278 | Bacillus Subtilis | 2200 | 0.32 | Functional ≤ 10μM |
| Z50212 | Z50212 | Escherichia Coli | 5000 | 0.30 | Functional ≤ 10μM |
