| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 30th, 2007 | 32 | No |
Popular Name: 4-(4-allyloxybenzoyl)-3-hydroxy-5-phenyl-1-(3-pyridylmethyl)-5H-pyrrol-2-one 4-(4-allyloxybenzoyl)-3-hydroxy-…
| 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) | 3.24 | 10.28 | -39.79 | 0 | 6 | -1 | 83 | 425.464 | 8 | ↓ |
| Mid Mid (pH 6-8) | 3.69 | 8.64 | -26.67 | 1 | 6 | 0 | 80 | 426.472 | 7 | ↓ |
| Mid Mid (pH 6-8) | 2.66 | 9.61 | -23.65 | 0 | 6 | 0 | 77 | 426.472 | 8 | ↓ |
| Lo Low (pH 4.5-6) | 3.69 | 8.94 | -54.27 | 2 | 6 | 1 | 81 | 427.48 | 7 | ↓ |
| Lo Low (pH 4.5-6) | 2.66 | 9.91 | -54.38 | 1 | 6 | 1 | 78 | 427.48 | 8 | ↓ |
