| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 20th, 2011 | 16 | Yes |
Popular Name: N-methyl-1-[2-(1,4-oxazepan-4-yl)-3-pyridyl]methanamine N-methyl-1-[2-(1,4-oxazepan-4-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) | 0.77 | 5.21 | -42.79 | 2 | 4 | 1 | 42 | 222.312 | 3 | ↓ |
| Hi High (pH 8-9.5) | 0.77 | 3.86 | -4.56 | 1 | 4 | 0 | 37 | 221.304 | 3 | ↓ |
| Mid Mid (pH 6-8) | 0.77 | 5.72 | -96.62 | 3 | 4 | 2 | 43 | 223.32 | 3 | ↓ |
