| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 13th, 2010 | 18 | Yes |
Popular Name: 3-[[2-cyanoethyl(isobutyl)amino]methyl]furan-2-carboxylic 3-[[2-cyanoethyl(isobutyl)amino]…
| 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) | 1.08 | 8.52 | -47.55 | 1 | 5 | 0 | 81 | 250.298 | 7 | ↓ |
| Mid Mid (pH 6-8) | 1.08 | 7.28 | -48.87 | 0 | 5 | -1 | 80 | 249.29 | 7 | ↓ |
