| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 22nd, 2010 | 20 | Yes |
Popular Name: (1S)-1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-N-methyl-2-[(1R)-1-methylpropoxy]ethanamine (1S)-1-(3,4-dihydro-2H-1,5-benzo…
| 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) | 2.68 | 6.61 | -41.85 | 2 | 4 | 1 | 44 | 280.388 | 6 | ↓ |
| Hi High (pH 8-9.5) | 2.68 | 5.51 | -4.95 | 1 | 4 | 0 | 40 | 279.38 | 6 | ↓ |
