In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 22nd, 2009 | 30 | Yes |
Popular Name: N-[6-[4-[(2R)-3-ethoxy-2-hydroxy-propyl]-1,4-diazepan-1-yl]-3-pyridyl]-2-phenyl-acetamide N-[6-[4-[(2R)-3-ethoxy-2-hydroxy…
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) | 2.17 | 8.5 | -45.79 | 3 | 7 | 1 | 79 | 413.542 | 9 | ↓ |
Lo Low (pH 4.5-6) | 2.17 | 8.85 | -99.66 | 4 | 7 | 2 | 80 | 414.55 | 9 | ↓ |