In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 22nd, 2011 | 24 | No |
Popular Name: N-[4-(3-aminophenyl)thiazol-2-yl]-7-(hydroxyamino)-7-oxo-heptanamide N-[4-(3-aminophenyl)thiazol-2-yl…
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) | 1.74 | 3.61 | -25.1 | 5 | 7 | 0 | 117 | 348.428 | 8 | ↓ |
Code | Description | Organism Class | Affinity (nM) | LE (kcal/mol/atom) | Type |
---|---|---|---|---|---|
Z50425-17-O | Plasmodium Falciparum (cluster #17 Of 22), Other | Other | 94 | 0.41 | Functional ≤ 10μM |
Uniprot | Swissprot | Description | Affinity (nM) | LE (kcal/mol/atom) | Type |
---|---|---|---|---|---|
Z50425 | Z50425 | Plasmodium Falciparum | 15.8 | 0.46 | Functional ≤ 10μM |