| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 6th, 2008 | 34 | No |
Popular Name: (5S)-4-(4-allyloxybenzoyl)-5-(4-ethylphenyl)-3-hydroxy-1-(3-pyridylmethyl)-5H-pyrrol-2-one (5S)-4-(4-allyloxybenzoyl)-5-(4-…
| 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) | 4.16 | 12.02 | -61.99 | 0 | 6 | -1 | 83 | 453.518 | 9 | ↓ |
| Mid Mid (pH 6-8) | 4.60 | 10.08 | -26.37 | 1 | 6 | 0 | 80 | 454.526 | 8 | ↓ |
| Mid Mid (pH 6-8) | 3.57 | 11.04 | -23.38 | 0 | 6 | 0 | 77 | 454.526 | 9 | ↓ |
| Lo Low (pH 4.5-6) | 4.60 | 10.43 | -53.07 | 2 | 6 | 1 | 81 | 455.534 | 8 | ↓ |
| Lo Low (pH 4.5-6) | 3.57 | 11.39 | -53.93 | 1 | 6 | 1 | 78 | 455.534 | 9 | ↓ |
