In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 20th, 2009 | 35 | No |
Popular Name: (4Z,5S)-1-benzyl-5-(4-hexoxyphenyl)-4-[hydroxy(4-pyridyl)methylene]pyrrolidine-2,3-dione (4Z,5S)-1-benzyl-5-(4-hexoxyphen…
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) | 4.99 | 13.83 | -52.35 | 0 | 6 | -1 | 83 | 469.561 | 11 | ↓ |
Lo Low (pH 4.5-6) | 4.99 | 12.54 | -17.91 | 1 | 6 | 0 | 80 | 470.569 | 11 | ↓ |