In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 5th, 2010 | 19 | No |
Popular Name: 2-(1,4-diazepan-1-yl)-2-oxo-N-[[(2S)-tetrahydropyran-2-yl]methyl]acetamide 2-(1,4-diazepan-1-yl)-2-oxo-N-[[…
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) | -0.78 | 2.17 | -42.44 | 3 | 6 | 1 | 75 | 270.353 | 3 | ↓ |
Hi High (pH 8-9.5) | -0.78 | 0.87 | -5.91 | 2 | 6 | 0 | 71 | 269.345 | 3 | ↓ |