In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 13th, 2010 | 24 | No |
Popular Name: dimethyl(pentyl)BLAHone dimethyl(pentyl)BLAHone
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) | 5.39 | 8.86 | -7.15 | 0 | 5 | 0 | 54 | 338.444 | 4 | ↓ |
Code | Description | Organism Class | Affinity (nM) | LE (kcal/mol/atom) | Type |
---|---|---|---|---|---|
Z50425-1-O | Plasmodium Falciparum (cluster #1 Of 22), Other | Other | 9 | 0.47 | Functional ≤ 10μM |
Uniprot | Swissprot | Description | Affinity (nM) | LE (kcal/mol/atom) | Type |
---|---|---|---|---|---|
Z50425 | Z50425 | Plasmodium Falciparum | 8.9 | 0.47 | Functional ≤ 10μM |