In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 15th, 2008 | 26 | No |
Popular Name: (4E,5S)-1-(2-furylmethyl)-4-(hydroxy-phenyl-methylene)-5-(2-thienyl)pyrrolidine-2,3-dione (4E,5S)-1-(2-furylmethyl)-4-(hyd…
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) | 2.93 | 8.2 | -60.19 | 0 | 5 | -1 | 74 | 364.402 | 5 | ↓ |
Mid Mid (pH 6-8) | 2.35 | 8.65 | -12.61 | 0 | 5 | 0 | 68 | 365.41 | 5 | ↓ |
Mid Mid (pH 6-8) | 2.93 | 8.29 | -13.38 | 1 | 5 | 0 | 71 | 365.41 | 5 | ↓ |