In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 21st, 2010 | 25 | Yes |
Popular Name: 2-[4-(2,5-dimethylfuran-3-carbonyl)piperazin-1-yl]-1-[(2S)-2-methyl-1-piperidyl]ethanone 2-[4-(2,5-dimethylfuran-3-carbon…
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) | 0.77 | 6.73 | -10.83 | 0 | 6 | 0 | 57 | 347.459 | 3 | ↓ |
Mid Mid (pH 6-8) | 0.77 | 8.85 | -45.38 | 1 | 6 | 1 | 58 | 348.467 | 3 | ↓ |