| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 29th, 2009 | 20 | Yes |
Popular Name: (1R,2S,3R,4R)-3,4-bis(2-furyl)cyclobutane-1,2-dicarboxylic (1R,2S,3R,4R)-3,4-bis(2-furyl)cy…
| 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) | 1.11 | 9.04 | -133.52 | 0 | 6 | -2 | 107 | 274.228 | 4 | ↓ |
| Mid Mid (pH 6-8) | 1.11 | 6.87 | -53.59 | 1 | 6 | -1 | 104 | 275.236 | 4 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| PUBCHEM_PATENT_ID | EP0677039A1; EP0677039B1; US5783593; WO1996034850A1 | IBM Patent Data |
