| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| January 30th, 2010 | 30 | No |
Popular Name: 2-[(N'E)-N'-[[4-[(E)-[(2-carboxyphenyl)hydrazono]methyl]phenyl]methylene]hydrazino]benzoic 2-[(N'E)-N'-[[4-[(E)-[(2-carboxy…
| 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) | 7.68 | 12.4 | -101.83 | 2 | 8 | -2 | 129 | 400.394 | 8 | ↓ |
| Code | Description | Organism Class | Affinity (nM) | LE (kcal/mol/atom) | Type |
|---|---|---|---|---|---|
| Q9N6S8-2-E | Falcipain 2 (cluster #2 Of 2), Eukaryotic | Eukaryotes | 1000 | 0.28 | Binding ≤ 10μM |
| Q9NBA7-2-E | Cysteine Protease Falcipain-3 (cluster #2 Of 2), Eukaryotic | Eukaryotes | 4900 | 0.25 | Binding ≤ 10μM |
| Uniprot | Swissprot | Description | Affinity (nM) | LE (kcal/mol/atom) | Type |
|---|---|---|---|---|---|
| Q9N6S8_PLAFA | Q9N6S8 | Falcipain 2, Plafa | 1000 | 0.28 | Binding ≤ 1μM |
| Q9NBA7_PLAFA | Q9NBA7 | Cysteine Protease Falcipain-3, Plafa | 4900 | 0.25 | Binding ≤ 10μM |
| Q9N6S8_PLAFA | Q9N6S8 | Falcipain 2, Plafa | 1000 | 0.28 | Binding ≤ 10μM |
