In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 7th, 2010 | 20 | Yes |
Popular Name: 4-[4-(2,5-dimethylfuran-3-carbonyl)piperazin-1-yl]butanenitrile 4-[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) | -0.09 | 5.67 | -14.44 | 0 | 5 | 0 | 60 | 275.352 | 4 | ↓ |
Lo Low (pH 4.5-6) | -0.09 | 7.87 | -58.26 | 1 | 5 | 1 | 62 | 276.36 | 4 | ↓ |