In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 17th, 2009 | 31 | No |
Popular Name: (4Z,5S)-1-benzyl-5-(4-ethoxyphenyl)-4-[hydroxy(4-pyridyl)methylene]pyrrolidine-2,3-dione (4Z,5S)-1-benzyl-5-(4-ethoxyphen…
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) | 2.92 | 10.72 | -52.76 | 0 | 6 | -1 | 83 | 413.453 | 7 | ↓ |
Lo Low (pH 4.5-6) | 2.92 | 9.43 | -18.24 | 1 | 6 | 0 | 80 | 414.461 | 7 | ↓ |