In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 29th, 2008 | 26 | No |
Popular Name: (4E,5R)-4-[hydroxy-(p-tolyl)methylene]-1-methyl-5-(3-nitrophenyl)pyrrolidine-2,3-dione (4E,5R)-4-[hydroxy-(p-tolyl)meth…
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) | 2.76 | 9.03 | -54.81 | 0 | 7 | -1 | 106 | 351.338 | 4 | ↓ |
Lo Low (pH 4.5-6) | 2.76 | 8.28 | -15.01 | 1 | 7 | 0 | 103 | 352.346 | 4 | ↓ |