| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 2nd, 2009 | 19 | No |
Popular Name: 1-[4-[[(2S)-tetrahydrofuran-2-yl]methyl]-1,4-diazepan-1-yl]butane-1,3-dione 1-[4-[[(2S)-tetrahydrofuran-2-yl…
| 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) | 0.02 | 8.03 | -45.78 | 1 | 5 | 1 | 51 | 269.365 | 4 | ↓ |
| Hi High (pH 8-9.5) | 0.76 | 6.85 | -60.7 | 1 | 5 | 0 | 57 | 268.357 | 3 | ↓ |
