| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 27th, 2007 | 34 | No |
Popular Name: 3-hydroxy-4-(4-isopropoxybenzoyl)-1-(3-morpholinopropyl)-5-(3-pyridyl)-5H-pyrrol-2-one 3-hydroxy-4-(4-isopropoxybenzoyl…
| 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) | 2.08 | -1.22 | -56.29 | 2 | 8 | 1 | 93 | 466.558 | 9 | ↓ |
| Mid Mid (pH 6-8) | 1.50 | -1.39 | -65.67 | 1 | 8 | 1 | 90 | 466.558 | 9 | ↓ |
| Lo Low (pH 4.5-6) | 1.50 | -1.28 | -119.38 | 2 | 8 | 2 | 91 | 467.566 | 9 | ↓ |
| Lo Low (pH 4.5-6) | 2.53 | -1.49 | -117.89 | 3 | 8 | 2 | 95 | 467.566 | 8 | ↓ |
