In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 16th, 2007 | 32 | No |
Popular Name: 4-(3-chloro-4-ethoxy-benzoyl)-1-(2-furylmethyl)-3-hydroxy-5-(p-tolyl)-5H-pyrrol-2-one 4-(3-chloro-4-ethoxy-benzoyl)-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) | 4.52 | 11.06 | -57.37 | 0 | 6 | -1 | 83 | 450.898 | 7 | ↓ |
Mid Mid (pH 6-8) | 4.97 | 1.02 | -26.78 | 1 | 6 | 0 | 79 | 451.906 | 6 | ↓ |
Mid Mid (pH 6-8) | 3.94 | 1.25 | -18.88 | 0 | 6 | 0 | 76 | 451.906 | 7 | ↓ |