In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 5th, 2009 | 13 | 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) | 3.98 | 5.85 | -38.87 | 3 | 1 | 1 | 28 | 184.347 | 2 | ↓ |
Code | Description | Organism Class | Affinity (nM) | LE (kcal/mol/atom) | Type |
---|---|---|---|---|---|
Z50418-3-O | Trypanosoma Brucei (cluster #3 Of 6), Other | Other | 3000 | 0.59 | Functional ≤ 10μM |
Uniprot | Swissprot | Description | Affinity (nM) | LE (kcal/mol/atom) | Type |
---|---|---|---|---|---|
Z50418 | Z50418 | Trypanosoma Brucei | 3000 | 0.59 | Functional ≤ 10μM |