In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 27th, 2006 | 31 | No |
Popular Name: 5-(3-allyloxyphenyl)-4-[hydroxy-(p-tolyl)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) | 3.76 | 9.8 | -44.58 | 0 | 6 | -1 | 79 | 420.485 | 10 | ↓ |
Mid Mid (pH 6-8) | 3.76 | 9.83 | -11.47 | 1 | 6 | 0 | 76 | 421.493 | 10 | ↓ |
Mid Mid (pH 6-8) | 3.18 | 10.53 | -19.31 | 0 | 6 | 0 | 73 | 421.493 | 10 | ↓ |