In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 25th, 2006 | 29 | No |
Popular Name: 3-hydroxy-1-[2-(2-hydroxyethoxy)ethyl]-4-(4-methylbenzoyl)-5-(p-tolyl)-5H-pyrrol-2-one 3-hydroxy-1-[2-(2-hydroxyethoxy)…
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) | 2.53 | 7.54 | -65.27 | 1 | 6 | -1 | 90 | 394.447 | 8 | ↓ |
Mid Mid (pH 6-8) | 2.98 | 5.59 | -32.13 | 2 | 6 | 0 | 87 | 395.455 | 7 | ↓ |
Mid Mid (pH 6-8) | 1.95 | 6.6 | -23.83 | 1 | 6 | 0 | 84 | 395.455 | 8 | ↓ |