| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 15th, 2007 | 36 | No |
Popular Name: 4-[(4-benzyloxyphenyl)-hydroxy-methylene]-5-phenyl-1-(3-pyridylmethyl)pyrrolidine-2,3-dione 4-[(4-benzyloxyphenyl)-hydroxy-m…
| 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) | 4.19 | 12.17 | -60.98 | 0 | 6 | -1 | 83 | 475.524 | 8 | ↓ |
| Mid Mid (pH 6-8) | 4.64 | 12.62 | -14.42 | 1 | 6 | 0 | 80 | 476.532 | 7 | ↓ |
| Mid Mid (pH 6-8) | 3.61 | -0.24 | -11.78 | 0 | 6 | 0 | 76 | 476.532 | 8 | ↓ |
| Lo Low (pH 4.5-6) | 4.64 | 12.91 | -43.34 | 2 | 6 | 1 | 81 | 477.54 | 7 | ↓ |
| Lo Low (pH 4.5-6) | 3.61 | -0.11 | -43.97 | 1 | 6 | 1 | 77 | 477.54 | 8 | ↓ |
