In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 27th, 2006 | 31 | No |
Popular Name: 5-(3-hydroxyphenyl)-4-[hydroxy-(p-tolyl)methylene]-1-phenethyl-pyrrolidine-2,3-dione 5-(3-hydroxyphenyl)-4-[hydroxy-(…
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) | 4.13 | 10.45 | -43.48 | 1 | 5 | -1 | 81 | 412.465 | 6 | ↓ |
Mid Mid (pH 6-8) | 3.54 | 10.46 | -21.72 | 1 | 5 | 0 | 75 | 413.473 | 6 | ↓ |
Mid Mid (pH 6-8) | 4.13 | 9.77 | -12.69 | 2 | 5 | 0 | 78 | 413.473 | 6 | ↓ |