In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 5th, 2009 | 15 | Yes |
Popular Name: [(2R,3S)-2,3-dimethylpiperazin-1-yl]-(2-furyl)methanone [(2R,3S)-2,3-dimethylpiperazin-1…
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) | 0.94 | 3.73 | -45.84 | 2 | 4 | 1 | 50 | 209.269 | 1 | ↓ |
Mid Mid (pH 6-8) | 0.94 | 2.46 | -8.65 | 1 | 4 | 0 | 45 | 208.261 | 1 | ↓ |