| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 25th, 2006 | 28 | No |
Popular Name: 4-(hydroxy-phenyl-methylene)-1-(3-imidazol-1-ylpropyl)-5-(2-thienyl)pyrrolidine-2,3-dione 4-(hydroxy-phenyl-methylene)-1-(…
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) | 2.23 | 10.32 | -64.44 | 0 | 6 | -1 | 78 | 392.46 | 7 | ↓ |
| Mid Mid (pH 6-8) | 1.65 | 10.97 | -43.32 | 1 | 6 | 1 | 74 | 394.476 | 7 | ↓ |
| Mid Mid (pH 6-8) | 1.65 | 10.46 | -17.45 | 0 | 6 | 0 | 72 | 393.468 | 7 | ↓ |
| Mid Mid (pH 6-8) | 2.68 | 9.94 | -17.87 | 1 | 6 | 0 | 75 | 393.468 | 6 | ↓ |
| Mid Mid (pH 6-8) | 2.68 | 10.67 | -46.64 | 2 | 6 | 1 | 77 | 394.476 | 6 | ↓ |
| Mid Mid (pH 6-8) | 2.23 | 10.8 | -76.13 | 1 | 6 | 0 | 80 | 393.468 | 7 | ↓ |
| Lo Low (pH 4.5-6) | 2.23 | 10.38 | -48.87 | 2 | 6 | 1 | 77 | 394.476 | 7 | ↓ |
