In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 10th, 2006 | 27 | No |
Popular Name: 1-(2-furylmethyl)-4-(hydroxy-phenyl-methylene)-5-(3-methyl-2-thienyl)-pyrrolidine-2,3-dione 1-(2-furylmethyl)-4-(hydroxy-phe…
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 | 8.94 | -60.41 | 0 | 5 | -1 | 74 | 378.429 | 5 | ↓ |
Mid Mid (pH 6-8) | 3.31 | 0.24 | -12.3 | 1 | 5 | 0 | 70 | 379.437 | 5 | ↓ |
Mid Mid (pH 6-8) | 2.73 | -0.03 | -10.46 | 0 | 5 | 0 | 67 | 379.437 | 5 | ↓ |