In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 24th, 2010 | 21 | No |
Popular Name: (2R)-4-hydroxy-3-(5-methylfuran-2-carbonyl)-2-(4-pyridyl)-1,2-dihydropyrrol-5-one (2R)-4-hydroxy-3-(5-methylfuran-…
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) | 0.32 | 2.36 | -54.83 | 1 | 6 | -1 | 95 | 283.263 | 3 | ↓ |
Lo Low (pH 4.5-6) | 0.32 | 1.59 | -13.12 | 2 | 6 | 0 | 92 | 284.271 | 3 | ↓ |
Lo Low (pH 4.5-6) | 0.32 | 2.05 | -42.89 | 3 | 6 | 1 | 94 | 285.279 | 3 | ↓ |
Lo Low (pH 4.5-6) | 0.32 | 2.81 | -64.65 | 2 | 6 | 0 | 97 | 284.271 | 3 | ↓ |