| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| February 1st, 2006 | 31 | No |
Popular Name: 4-(3-ethoxybenzoyl)-3-hydroxy-5-phenyl-1-(4-pyridinylmethyl)-1,5-dihydro-2H-pyrrol-2-one 4-(3-ethoxybenzoyl)-3-hydroxy-5-…
| 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) | 2.90 | 9.99 | -61.83 | 0 | 6 | -1 | 83 | 413.453 | 7 | ↓ |
| Mid Mid (pH 6-8) | 3.34 | -0.01 | -18.13 | 1 | 6 | 0 | 79 | 414.461 | 6 | ↓ |
| Mid Mid (pH 6-8) | 2.31 | 0.1 | -24.58 | 0 | 6 | 0 | 76 | 414.461 | 7 | ↓ |
| Lo Low (pH 4.5-6) | 2.90 | 9.6 | -55.74 | 2 | 6 | 1 | 81 | 415.469 | 7 | ↓ |
