In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 27th, 2006 | 25 | No |
Popular Name: 1-(2-hydroxyethyl)-4-(hydroxy-phenyl-methylene)-5-(p-tolyl)pyrrolidine-2,3-dione 1-(2-hydroxyethyl)-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) | 2.19 | 5.8 | -63.62 | 1 | 5 | -1 | 81 | 336.367 | 5 | ↓ |
Mid Mid (pH 6-8) | 1.61 | 6.28 | -24.38 | 1 | 5 | 0 | 75 | 337.375 | 5 | ↓ |
Mid Mid (pH 6-8) | 2.64 | 4.98 | -18.92 | 2 | 5 | 0 | 78 | 337.375 | 4 | ↓ |