In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
June 22nd, 2008 | 26 | No |
Popular Name: (4E,5R)-4-[hydroxy-(p-tolyl)methylene]-1-thiazol-2-yl-5-(2-thienyl)pyrrolidine-2,3-dione (4E,5R)-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) | 3.48 | 8.71 | -63.11 | 0 | 5 | -1 | 73 | 381.458 | 4 | ↓ |
Mid Mid (pH 6-8) | 3.48 | 8.6 | -14.67 | 1 | 5 | 0 | 71 | 382.466 | 4 | ↓ |
Mid Mid (pH 6-8) | 2.89 | 8.99 | -14.12 | 0 | 5 | 0 | 67 | 382.466 | 4 | ↓ |