| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 21st, 2006 | 31 | No |
Popular Name: 3-hydroxy-4-(4-methoxy-2-methyl-benzoyl)-5-phenyl-1-(3-pyridylmethyl)-5H-pyrrol-2-one 3-hydroxy-4-(4-methoxy-2-methyl-…
| 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) | 2.97 | 9.43 | -40.5 | 0 | 6 | -1 | 83 | 413.453 | 6 | ↓ |
| Mid Mid (pH 6-8) | 3.42 | 8.07 | -27.55 | 1 | 6 | 0 | 80 | 414.461 | 5 | ↓ |
| Mid Mid (pH 6-8) | 2.39 | 9.48 | -19.66 | 0 | 6 | 0 | 77 | 414.461 | 6 | ↓ |
| Lo Low (pH 4.5-6) | 3.42 | 8.38 | -56.47 | 2 | 6 | 1 | 81 | 415.469 | 5 | ↓ |
| Lo Low (pH 4.5-6) | 2.39 | 9.77 | -52.25 | 1 | 6 | 1 | 78 | 415.469 | 6 | ↓ |
