| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 27th, 2007 | 34 | No |
Popular Name: 3-hydroxy-1-(2-methoxyethyl)-4-[4-(m-tolylmethoxy)benzoyl]-5-(4-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) | 3.15 | 9.71 | -61.38 | 0 | 7 | -1 | 92 | 457.506 | 9 | ↓ |
| Mid Mid (pH 6-8) | 3.60 | 8.71 | -31.75 | 1 | 7 | 0 | 89 | 458.514 | 8 | ↓ |
| Mid Mid (pH 6-8) | 2.57 | 9.67 | -26.12 | 0 | 7 | 0 | 86 | 458.514 | 9 | ↓ |
| Lo Low (pH 4.5-6) | 3.15 | 9.28 | -50.13 | 2 | 7 | 1 | 90 | 459.522 | 9 | ↓ |
| Lo Low (pH 4.5-6) | 2.57 | 9.95 | -62.85 | 1 | 7 | 1 | 87 | 459.522 | 9 | ↓ |
