| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 9th, 2004 | 32 | No |
Popular Name: (5S)-4-benzoyl-1-benzyl-5-(3,4-dimethoxyphenyl)-2-keto-3-pyrrolin-3-olate (5S)-4-benzoyl-1-benzyl-5-(3,4-d…
| 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) | 3.42 | 11.62 | -60.6 | 0 | 6 | -1 | 79 | 428.464 | 7 | ↓ |
| Mid Mid (pH 6-8) | 3.87 | 9.57 | -29.9 | 1 | 6 | 0 | 76 | 429.472 | 6 | ↓ |
| Mid Mid (pH 6-8) | 2.84 | 10.56 | -22.82 | 0 | 6 | 0 | 73 | 429.472 | 7 | ↓ |
