| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| January 25th, 2006 | 29 | No |
Popular Name: 3-hydroxy-4-(4-methoxybenzoyl)-1-(5-methylisoxazol-3-yl)-5-(3-pyridyl)-5H-pyrrol-2-one 3-hydroxy-4-(4-methoxybenzoyl)-1…
| 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) | 1.73 | 8.32 | -64.81 | 0 | 8 | -1 | 109 | 390.375 | 5 | ↓ |
| Mid Mid (pH 6-8) | 2.17 | 0.53 | -27.25 | 1 | 8 | 0 | 105 | 391.383 | 4 | ↓ |
| Mid Mid (pH 6-8) | 1.14 | 0.82 | -19.7 | 0 | 8 | 0 | 102 | 391.383 | 5 | ↓ |
| Lo Low (pH 4.5-6) | 2.17 | 0.64 | -56.12 | 2 | 8 | 1 | 107 | 392.391 | 4 | ↓ |
