In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 24th, 2006 | 28 | No |
Popular Name: 4-(hydroxy-phenyl-methylene)-1-(2-methoxyethyl)-5-(4-nitrophenyl)-pyrrolidine-2,3-dione 4-(hydroxy-phenyl-methylene)-1-(…
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) | 2.32 | 7.91 | -57.8 | 0 | 8 | -1 | 115 | 381.364 | 7 | ↓ |
Mid Mid (pH 6-8) | 2.77 | 0.56 | -24.29 | 1 | 8 | 0 | 112 | 382.372 | 6 | ↓ |
Mid Mid (pH 6-8) | 1.74 | 0.21 | -16.83 | 0 | 8 | 0 | 109 | 382.372 | 7 | ↓ |