In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 3rd, 2007 | 29 | No |
Popular Name: 5-(4-allyloxyphenyl)-4-(2-furyl-hydroxy-methylene)-1-(3-methoxypropyl)pyrrolidine-2,3-dione 5-(4-allyloxyphenyl)-4-(2-furyl-…
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) | 2.59 | 6.97 | -61.77 | 0 | 7 | -1 | 92 | 396.419 | 10 | ↓ |
Mid Mid (pH 6-8) | 2.01 | 8.34 | -14.53 | 0 | 7 | 0 | 86 | 397.427 | 10 | ↓ |
Mid Mid (pH 6-8) | 2.59 | 6.14 | -16.67 | 1 | 7 | 0 | 89 | 397.427 | 10 | ↓ |