| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| March 15th, 2006 | 20 | No |
Popular Name: ethyl 3-(7-hydroxy-2-oxo-2H-chromen-3-yl)-3-oxopropanoate ethyl 3-(7-hydroxy-2-oxo-2H-chro…
| 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) | 1.16 | 6.68 | -34.39 | 1 | 6 | 0 | 94 | 276.244 | 5 | ↓ |
| Mid Mid (pH 6-8) | 1.16 | 7.48 | -59.82 | 0 | 6 | -1 | 97 | 275.236 | 5 | ↓ |
| Code | Description | Organism Class | Affinity (nM) | LE (kcal/mol/atom) | Type |
|---|---|---|---|---|---|
| MIF-1-E | Macrophage Migration Inhibitory Factor (cluster #1 Of 3), Eukaryotic | Eukaryotes | 5800 | 0.37 | Binding ≤ 10μM |
| Uniprot | Swissprot | Description | Affinity (nM) | LE (kcal/mol/atom) | Type |
|---|---|---|---|---|---|
| MIF_HUMAN | P14174 | Macrophage Migration Inhibitory Factor, Human | 5800 | 0.37 | Binding ≤ 10μM |
