In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 24th, 2010 | 26 | No |
Popular Name: (2S)-3-(4-allyloxy-3-methyl-benzoyl)-4-hydroxy-2-(4-pyridyl)-1,2-dihydropyrrol-5-one (2S)-3-(4-allyloxy-3-methyl-benz…
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) | 1.92 | 4.76 | -54.52 | 1 | 6 | -1 | 91 | 349.366 | 6 | ↓ |
Lo Low (pH 4.5-6) | 1.92 | 4 | -14.94 | 2 | 6 | 0 | 89 | 350.374 | 6 | ↓ |