| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 21st, 2007 | 35 | No |
Popular Name: 1-(3-dibutylaminopropyl)-3-hydroxy-4-(4-methoxybenzoyl)-5-(3-pyridyl)-5H-pyrrol-2-one 1-(3-dibutylaminopropyl)-3-hydro…
| 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) | 4.37 | 10.99 | -49.22 | 2 | 7 | 1 | 84 | 480.629 | 14 | ↓ |
| Mid Mid (pH 6-8) | 3.79 | 11.65 | -59.78 | 1 | 7 | 1 | 81 | 480.629 | 14 | ↓ |
| Lo Low (pH 4.5-6) | 4.82 | 10.96 | -129.18 | 3 | 7 | 2 | 85 | 481.637 | 13 | ↓ |
| Lo Low (pH 4.5-6) | 3.79 | 11.94 | -127.4 | 2 | 7 | 2 | 82 | 481.637 | 14 | ↓ |
