| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| March 19th, 2006 | 27 | No |
Popular Name: 3-hydroxy-1-(2-methoxyethyl)-4-(3-phenylprop-2-enoyl)-5-(3-pyridyl)-5H-pyrrol-2-one 3-hydroxy-1-(2-methoxyethyl)-4-(…
| 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) | 1.50 | -0.21 | -18.4 | 1 | 6 | 0 | 79 | 364.401 | 7 | ↓ |
| Mid Mid (pH 6-8) | 1.50 | -0.25 | -26.86 | 1 | 6 | 0 | 79 | 364.401 | 6 | ↓ |
| Mid Mid (pH 6-8) | 0.92 | -0.41 | -28.21 | 0 | 6 | 0 | 76 | 364.401 | 7 | ↓ |
| Lo Low (pH 4.5-6) | 1.50 | -0.13 | -62.13 | 2 | 6 | 1 | 80 | 365.409 | 6 | ↓ |
| Lo Low (pH 4.5-6) | 1.50 | -0.4 | -69.17 | 2 | 6 | 1 | 80 | 365.409 | 6 | ↓ |
