In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 16th, 2006 | 34 | No |
Popular Name: 4-[hydroxy-(4-methoxyphenyl)-methylene]-5-(2-nitrophenyl)-1-phenethyl-pyrrolidine-2,3-dione 4-[hydroxy-(4-methoxyphenyl)-met…
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) | 4.15 | 12.05 | -56.33 | 0 | 8 | -1 | 115 | 457.462 | 8 | ↓ |
Mid Mid (pH 6-8) | 4.15 | 1.07 | -11.2 | 1 | 8 | 0 | 112 | 458.47 | 8 | ↓ |
Mid Mid (pH 6-8) | 3.57 | 1.19 | -16.9 | 0 | 8 | 0 | 109 | 458.47 | 8 | ↓ |