| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 12th, 2005 | 25 | No |
Popular Name: 3-hydroxy-1-(2-hydroxypropyl)-4-(4-methylbenzoyl)-5-(2-thienyl)-1,5-dihydro-2H-pyrrol-2-one 3-hydroxy-1-(2-hydroxypropyl)-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) | 2.46 | 5.54 | -60.6 | 1 | 5 | -1 | 81 | 356.423 | 5 | ↓ |
| Mid Mid (pH 6-8) | 2.90 | -3.56 | -26.87 | 2 | 5 | 0 | 77 | 357.431 | 4 | ↓ |
| Mid Mid (pH 6-8) | 1.87 | -3.36 | -18.33 | 1 | 5 | 0 | 74 | 357.431 | 5 | ↓ |
