In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 18th, 2006 | 31 | No |
Popular Name: 1-benzyl-5-(4-hydroxy-3-methoxy-phenyl)-4-(hydroxy-phenyl-methylene)-pyrrolidine-2,3-dione 1-benzyl-5-(4-hydroxy-3-methoxy-…
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) | 3.12 | 8.24 | -45.58 | 1 | 6 | -1 | 90 | 414.437 | 6 | ↓ |
Mid Mid (pH 6-8) | 2.53 | -1.14 | -26.08 | 1 | 6 | 0 | 83 | 415.445 | 6 | ↓ |
Lo Low (pH 4.5-6) | 3.12 | 7.11 | -21.6 | 2 | 6 | 0 | 87 | 415.445 | 6 | ↓ |