In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 23rd, 2010 | 27 | No |
Popular Name: (2S)-3-(benzofuran-2-carbonyl)-4-hydroxy-1-(2-hydroxyethyl)-2-(3-pyridyl)-2H-pyrrol-5-one (2S)-3-(benzofuran-2-carbonyl)-4…
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) | 1.07 | 4.71 | -59.71 | 1 | 7 | -1 | 107 | 363.349 | 5 | ↓ |
Lo Low (pH 4.5-6) | 1.07 | 3.82 | -13.15 | 2 | 7 | 0 | 104 | 364.357 | 5 | ↓ |
Lo Low (pH 4.5-6) | 1.07 | 4.3 | -41.18 | 3 | 7 | 1 | 105 | 365.365 | 5 | ↓ |