In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 2nd, 2006 | 25 | No |
Popular Name: 5-(4-bromophenyl)-4-[hydroxy-(4-methoxyphenyl)-methylene]-1-methyl-pyrrolidine-2,3-dione 5-(4-bromophenyl)-4-[hydroxy-(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) | 3.24 | 7.46 | -56.16 | 0 | 5 | -1 | 70 | 401.236 | 4 | ↓ |
Mid Mid (pH 6-8) | 3.69 | -0.27 | -18.2 | 1 | 5 | 0 | 66 | 402.244 | 3 | ↓ |
Mid Mid (pH 6-8) | 2.66 | -0.44 | -11.51 | 0 | 5 | 0 | 63 | 402.244 | 4 | ↓ |