In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 10th, 2006 | 31 | No |
Popular Name: 5-(3-ethoxyphenyl)-4-(hydroxy-phenyl-methylene)-1-(4-pyridylmethyl)pyrrolidine-2,3-dione 5-(3-ethoxyphenyl)-4-(hydroxy-ph…
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) | 2.90 | 9.14 | -59.38 | 0 | 6 | -1 | 83 | 413.453 | 7 | ↓ |
Mid Mid (pH 6-8) | 2.31 | -0.29 | -22.2 | 0 | 6 | 0 | 76 | 414.461 | 7 | ↓ |
Lo Low (pH 4.5-6) | 2.90 | 8.39 | -14.28 | 1 | 6 | 0 | 80 | 414.461 | 7 | ↓ |
Lo Low (pH 4.5-6) | 2.90 | 8.86 | -42.99 | 2 | 6 | 1 | 81 | 415.469 | 7 | ↓ |