| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 14th, 2011 | 18 | Yes |
Popular Name: (5R)-1-(1,3-benzodioxol-5-ylmethyl)-5-methyl-1,4-diazepane (5R)-1-(1,3-benzodioxol-5-ylmeth…
| 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) | 1.88 | 4.58 | -38.41 | 2 | 4 | 1 | 35 | 249.334 | 2 | ↓ |
| Lo Low (pH 4.5-6) | 1.88 | 5.77 | -118.03 | 3 | 4 | 2 | 40 | 250.342 | 2 | ↓ |
| Lo Low (pH 4.5-6) | 1.88 | 3.67 | -37.81 | 2 | 4 | 1 | 38 | 249.334 | 2 | ↓ |
