| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 20th, 2010 | 28 | No |
Popular Name: (2S)-3-(1,3-benzodioxole-5-carbonyl)-4-hydroxy-1-methyl-2-(4-nitrophenyl)-2H-pyrrol-5-one (2S)-3-(1,3-benzodioxole-5-carbo…
| 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) | 2.23 | 6.87 | -54.79 | 0 | 9 | -1 | 125 | 381.32 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 2.23 | 6.13 | -19.82 | 1 | 9 | 0 | 122 | 382.328 | 4 | ↓ |
