In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 9th, 2010 | 19 | Yes |
Popular Name: 5-chloro-2-[4-chloro-2-(methylaminomethyl)phenoxy]phenol 5-chloro-2-[4-chloro-2-(methylam…
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) | 4.01 | 6.17 | -41.02 | 3 | 3 | 1 | 46 | 299.177 | 4 | ↓ |
Code | Description | Organism Class | Affinity (nM) | LE (kcal/mol/atom) | Type |
---|---|---|---|---|---|
Z50425-9-O | Plasmodium Falciparum (cluster #9 Of 22), Other | Other | 580 | 0.46 | Functional ≤ 10μM |
Uniprot | Swissprot | Description | Affinity (nM) | LE (kcal/mol/atom) | Type |
---|---|---|---|---|---|
Z50425 | Z50425 | Plasmodium Falciparum | 470 | 0.47 | Functional ≤ 10μM |