In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 27th, 2006 | 29 | No |
Popular Name: 4-[hydroxy-(p-tolyl)methylene]-1-phenethyl-5-(2-thienyl)pyrrolidine-2,3-dione 4-[hydroxy-(p-tolyl)methylene]-1…
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) | 4.53 | 11.6 | -41.96 | 0 | 4 | -1 | 60 | 402.495 | 6 | ↓ |
Mid Mid (pH 6-8) | 4.53 | 11.66 | -11.77 | 1 | 4 | 0 | 58 | 403.503 | 6 | ↓ |
Mid Mid (pH 6-8) | 3.95 | 12.34 | -21.35 | 0 | 4 | 0 | 54 | 403.503 | 6 | ↓ |