| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 21st, 2009 | 21 | Yes |
Popular Name: (1R)-1-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-(4-methyl-1,4-diazepan-1-yl)ethanamine (1R)-1-(2,3-dihydro-1,4-benzodio…
| 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) | -0.87 | 3.89 | -36.52 | 3 | 5 | 1 | 52 | 292.403 | 3 | ↓ |
| Hi High (pH 8-9.5) | -0.87 | 4.18 | -36.19 | 3 | 5 | 1 | 52 | 292.403 | 3 | ↓ |
| Hi High (pH 8-9.5) | -0.87 | 2.78 | -46.72 | 3 | 5 | 1 | 53 | 292.403 | 3 | ↓ |
| Hi High (pH 8-9.5) | -0.87 | 2.36 | -5.18 | 2 | 5 | 0 | 51 | 291.395 | 3 | ↓ |
