| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 3rd, 2006 | 30 | No |
Popular Name: 3-hydroxy-4-(4-isobutoxybenzoyl)-1-(2-methoxyethyl)-5-(3-pyridyl)-5H-pyrrol-2-one 3-hydroxy-4-(4-isobutoxybenzoyl)…
| 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) | 2.30 | 7.44 | -42.31 | 0 | 7 | -1 | 92 | 409.462 | 9 | ↓ |
| Mid Mid (pH 6-8) | 1.72 | 6.96 | -25.17 | 0 | 7 | 0 | 86 | 410.47 | 9 | ↓ |
| Lo Low (pH 4.5-6) | 2.30 | 6.56 | -46.47 | 2 | 7 | 1 | 90 | 411.478 | 9 | ↓ |
| Lo Low (pH 4.5-6) | 1.72 | 7.26 | -58.89 | 1 | 7 | 1 | 87 | 411.478 | 9 | ↓ |
