In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 27th, 2006 | 29 | No |
Popular Name: 1-benzyl-5-(4-fluorophenyl)-4-[hydroxy-(4-pyridyl)methylene]-pyrrolidine-2,3-dione 1-benzyl-5-(4-fluorophenyl)-4-[h…
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) | 2.65 | 10.23 | -35.62 | 0 | 5 | -1 | 73 | 387.39 | 5 | ↓ |
Mid Mid (pH 6-8) | 2.07 | 9.81 | -22.18 | 0 | 5 | 0 | 67 | 388.398 | 5 | ↓ |
Lo Low (pH 4.5-6) | 2.07 | 10.09 | -74.05 | 1 | 5 | 1 | 69 | 389.406 | 5 | ↓ |
Lo Low (pH 4.5-6) | 2.65 | 9.1 | -16.78 | 1 | 5 | 0 | 71 | 388.398 | 5 | ↓ |