In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 1st, 2006 | 27 | No |
Popular Name: 5-(3-hydroxyphenyl)-4-[hydroxy-(p-tolyl)methylene]-1-isobutyl-pyrrolidine-2,3-dione 5-(3-hydroxyphenyl)-4-[hydroxy-(…
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) | 3.45 | 8.01 | -42.82 | 1 | 5 | -1 | 81 | 364.421 | 5 | ↓ |
Mid Mid (pH 6-8) | 2.86 | -0.45 | -21.29 | 1 | 5 | 0 | 74 | 365.429 | 5 | ↓ |
Mid Mid (pH 6-8) | 3.89 | 6.65 | -28.81 | 2 | 5 | 0 | 78 | 365.429 | 4 | ↓ |