| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 3rd, 2008 | 28 | No |
Popular Name: (5S)-3-hydroxy-1-(2-hydroxyethyl)-4-(4-methylbenzoyl)-5-(3-nitrophenyl)-5H-pyrrol-2-one (5S)-3-hydroxy-1-(2-hydroxyethyl…
| 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) | 2.13 | 6.49 | -60.03 | 1 | 8 | -1 | 126 | 381.364 | 6 | ↓ |
| Mid Mid (pH 6-8) | 2.58 | 5.46 | -30.75 | 2 | 8 | 0 | 124 | 382.372 | 5 | ↓ |
| Mid Mid (pH 6-8) | 1.55 | 6.47 | -23.25 | 1 | 8 | 0 | 121 | 382.372 | 6 | ↓ |
