In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 24th, 2006 | 30 | No |
Popular Name: 4-benzoyl-3-hydroxy-1-[2-(2-hydroxyethoxy)ethyl]-5-(4-isopropylphenyl)-5H-pyrrol-2-one 4-benzoyl-3-hydroxy-1-[2-(2-hydr…
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) | 3.15 | 8.15 | -60.49 | 1 | 6 | -1 | 90 | 408.474 | 9 | ↓ |
Mid Mid (pH 6-8) | 3.59 | -2.84 | -31.91 | 2 | 6 | 0 | 87 | 409.482 | 8 | ↓ |
Mid Mid (pH 6-8) | 2.56 | -2.61 | -23.52 | 1 | 6 | 0 | 83 | 409.482 | 9 | ↓ |