In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 8th, 2006 | 29 | No |
Popular Name: 1-hexyl-4-[hydroxy-(p-tolyl)methylene]-5-(p-tolyl)pyrrolidine-2,3-dione 1-hexyl-4-[hydroxy-(p-tolyl)meth…
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) | 5.72 | 12.97 | -60.29 | 0 | 4 | -1 | 60 | 390.503 | 8 | ↓ |
Mid Mid (pH 6-8) | 6.17 | 1.96 | -17.58 | 1 | 4 | 0 | 57 | 391.511 | 7 | ↓ |
Mid Mid (pH 6-8) | 5.14 | 1.43 | -9.24 | 0 | 4 | 0 | 54 | 391.511 | 8 | ↓ |