In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 20th, 2010 | 24 | No |
Popular Name: (2S)-3-[(E)-3-(2-furyl)prop-2-enoyl]-4-hydroxy-1-methyl-2-(p-tolyl)-2H-pyrrol-5-one (2S)-3-[(E)-3-(2-furyl)prop-2-en…
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) | 2.28 | 8.51 | -60.66 | 0 | 5 | -1 | 74 | 322.34 | 4 | ↓ |
Lo Low (pH 4.5-6) | 2.28 | 7.65 | -12.81 | 1 | 5 | 0 | 71 | 323.348 | 4 | ↓ |