| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 25th, 2004 | 32 | No |
Popular Name: 4-(4-ethoxybenzoyl)-3-hydroxy-1-(2-phenylethyl)-5-pyridin-4-yl-1,5-dihydro-2H-pyrrol-2-one 4-(4-ethoxybenzoyl)-3-hydroxy-1-…
| 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) | 3.33 | 11.14 | -38.77 | 0 | 6 | -1 | 83 | 427.48 | 8 | ↓ |
| Mid Mid (pH 6-8) | 3.77 | -0.7 | -27.72 | 1 | 6 | 0 | 79 | 428.488 | 7 | ↓ |
| Mid Mid (pH 6-8) | 2.74 | -0.47 | -21.26 | 0 | 6 | 0 | 76 | 428.488 | 8 | ↓ |
| Lo Low (pH 4.5-6) | 3.77 | -0.59 | -69.23 | 2 | 6 | 1 | 80 | 429.496 | 7 | ↓ |
| Lo Low (pH 4.5-6) | 2.74 | -0.36 | -61.76 | 1 | 6 | 1 | 77 | 429.496 | 8 | ↓ |
