| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 6th, 2008 | 34 | No |
Popular Name: (5R)-4-(4-allyloxybenzoyl)-3-hydroxy-5-(3-methoxyphenyl)-1-(3-pyridylmethyl)-5H-pyrrol-2-one (5R)-4-(4-allyloxybenzoyl)-3-hyd…
| 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) | 3.27 | 9.95 | -53.66 | 0 | 7 | -1 | 92 | 455.49 | 9 | ↓ |
| Mid Mid (pH 6-8) | 3.72 | 8 | -26.21 | 1 | 7 | 0 | 89 | 456.498 | 8 | ↓ |
| Mid Mid (pH 6-8) | 2.69 | 9.02 | -20.19 | 0 | 7 | 0 | 86 | 456.498 | 9 | ↓ |
| Lo Low (pH 4.5-6) | 3.72 | 8.3 | -54.78 | 2 | 7 | 1 | 90 | 457.506 | 8 | ↓ |
| Lo Low (pH 4.5-6) | 2.69 | 9.32 | -52.74 | 1 | 7 | 1 | 87 | 457.506 | 9 | ↓ |
