In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 6th, 2006 | 29 | No |
Popular Name: 1-benzyl-4-[(4-chlorophenyl)-hydroxy-methylene]-5-(5-methyl-2-furyl)-pyrrolidine-2,3-dione 1-benzyl-4-[(4-chlorophenyl)-hyd…
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) | 3.93 | 11.56 | -53.86 | 0 | 5 | -1 | 74 | 406.845 | 5 | ↓ |
Mid Mid (pH 6-8) | 3.35 | 10.85 | -10.15 | 0 | 5 | 0 | 68 | 407.853 | 5 | ↓ |
Mid Mid (pH 6-8) | 3.93 | 10.48 | -11.15 | 1 | 5 | 0 | 71 | 407.853 | 5 | ↓ |