In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 10th, 2006 | 30 | No |
Popular Name: 5-(3-allyloxyphenyl)-4-(hydroxy-phenyl-methylene)-1-(3-methoxypropyl)pyrrolidine-2,3-dione 5-(3-allyloxyphenyl)-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) | 3.31 | 9.06 | -59.97 | 0 | 6 | -1 | 79 | 406.458 | 10 | ↓ |
Mid Mid (pH 6-8) | 3.31 | 0.4 | -14.19 | 1 | 6 | 0 | 76 | 407.466 | 10 | ↓ |
Mid Mid (pH 6-8) | 2.73 | 0.25 | -13.06 | 0 | 6 | 0 | 72 | 407.466 | 10 | ↓ |