| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 10th, 2009 | 30 | No |
Popular Name: (2S)-4-hydroxy-1-[2-(2-hydroxyethylamino)ethyl]-3-(4-nitrobenzoyl)-2-phenyl-2H-pyrrol-5-one (2S)-4-hydroxy-1-[2-(2-hydroxyet…
| 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) | 1.14 | 6.01 | -69.66 | 3 | 9 | 0 | 143 | 411.414 | 9 | ↓ |
| Hi High (pH 8-9.5) | 1.14 | 4.61 | -52.65 | 2 | 9 | -1 | 139 | 410.406 | 9 | ↓ |
| Lo Low (pH 4.5-6) | 1.14 | 5.26 | -57.23 | 4 | 9 | 1 | 140 | 412.422 | 9 | ↓ |
