| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 8th, 2004 | 35 | No |
Popular Name: (5S)-1-benzyl-5-(4-carbomethoxyphenyl)-4-(4-ethoxybenzoyl)-2-keto-3-pyrrolin-3-olate (5S)-1-benzyl-5-(4-carbomethoxyp…
| 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) | 4.38 | 12.84 | -40.59 | 0 | 7 | -1 | 96 | 470.501 | 9 | ↓ |
| Mid Mid (pH 6-8) | 4.83 | 11.42 | -30.06 | 1 | 7 | 0 | 93 | 471.509 | 8 | ↓ |
| Mid Mid (pH 6-8) | 3.80 | 12.42 | -22.18 | 0 | 7 | 0 | 90 | 471.509 | 9 | ↓ |
