In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 7th, 2006 | 26 | No |
Popular Name: 1-allyl-5-(4-chlorophenyl)-4-[(4-chlorophenyl)-hydroxy-methylene]-pyrrolidine-2,3-dione 1-allyl-5-(4-chlorophenyl)-4-[(4…
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) | 4.38 | 9.77 | -53.83 | 0 | 4 | -1 | 60 | 387.242 | 5 | ↓ |
Mid Mid (pH 6-8) | 4.82 | 1.26 | -17.5 | 1 | 4 | 0 | 57 | 388.25 | 4 | ↓ |
Mid Mid (pH 6-8) | 3.79 | 0.73 | -9.07 | 0 | 4 | 0 | 54 | 388.25 | 5 | ↓ |