| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 7th, 2007 | 34 | No |
Popular Name: 5-(3,4-diethoxyphenyl)-4-(hydroxy-phenyl-methylene)-1-(3-pyridylmethyl)pyrrolidine-2,3-dione 5-(3,4-diethoxyphenyl)-4-(hydrox…
| 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) | 2.94 | 10.02 | -61.08 | 0 | 7 | -1 | 92 | 457.506 | 9 | ↓ |
| Mid Mid (pH 6-8) | 3.38 | 8.98 | -21.04 | 1 | 7 | 0 | 89 | 458.514 | 8 | ↓ |
| Mid Mid (pH 6-8) | 2.36 | 10.27 | -14.28 | 0 | 7 | 0 | 86 | 458.514 | 9 | ↓ |
| Lo Low (pH 4.5-6) | 2.36 | 10.55 | -45.33 | 1 | 7 | 1 | 87 | 459.522 | 9 | ↓ |
| Lo Low (pH 4.5-6) | 3.38 | 9.26 | -45.4 | 2 | 7 | 1 | 90 | 459.522 | 8 | ↓ |
