In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 31st, 2008 | 28 | No |
Popular Name: N-benzyl-2-[[2-oxo-2-[(2,3,4-trifluorophenyl)amino]ethyl]-propyl-amino]acetamide N-benzyl-2-[[2-oxo-2-[(2,3,4-tri…
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) | 3.75 | 8.8 | -46.71 | 3 | 5 | 1 | 63 | 394.417 | 9 | ↓ |
Hi High (pH 8-9.5) | 3.75 | 6.83 | -12.37 | 2 | 5 | 0 | 61 | 393.409 | 9 | ↓ |
Hi High (pH 8-9.5) | 3.56 | 7.88 | -37.77 | 2 | 5 | 0 | 69 | 393.409 | 9 | ↓ |