In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 4th, 2010 | 45 | 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) | 8.42 | 15.58 | -11.76 | 2 | 8 | 0 | 119 | 630.863 | 18 | ↓ |
Code | Description | Organism Class | Affinity (nM) | LE (kcal/mol/atom) | Type |
---|---|---|---|---|---|
Z50425-4-O | Plasmodium Falciparum (cluster #4 Of 22), Other | Other | 6310 | 0.16 | Functional ≤ 10μM |
Uniprot | Swissprot | Description | Affinity (nM) | LE (kcal/mol/atom) | Type |
---|---|---|---|---|---|
Z50425 | Z50425 | Plasmodium Falciparum | 6309.57344 | 0.16 | Functional ≤ 10μM |