| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| March 8th, 2006 | 33 | No |
Popular Name: 3-hydroxy-4-(4-isopropoxybenzoyl)-1-(2-morpholinoethyl)-5-(4-pyridyl)-5H-pyrrol-2-one 3-hydroxy-4-(4-isopropoxybenzoyl…
| 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) | 1.76 | -1.34 | -56.79 | 2 | 8 | 1 | 93 | 452.531 | 8 | ↓ |
| Mid Mid (pH 6-8) | 1.18 | -1.45 | -68.9 | 1 | 8 | 1 | 90 | 452.531 | 8 | ↓ |
| Lo Low (pH 4.5-6) | 2.21 | -1.6 | -125.32 | 3 | 8 | 2 | 94 | 453.539 | 7 | ↓ |
| Lo Low (pH 4.5-6) | 1.18 | -1.34 | -127.84 | 2 | 8 | 2 | 91 | 453.539 | 8 | ↓ |
