| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 13th, 2008 | 19 | Yes |
Popular Name: N-[(1R)-1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)ethyl]-N',N'-dimethyl-ethane-1,2-diamine N-[(1R)-1-(3,4-dihydro-2H-1,5-be…
| 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) | 1.86 | 4.81 | -46.61 | 2 | 4 | 1 | 38 | 265.377 | 5 | ↓ |
| Hi High (pH 8-9.5) | 1.86 | 3.54 | -5.7 | 1 | 4 | 0 | 34 | 264.369 | 5 | ↓ |
| Mid Mid (pH 6-8) | 1.86 | 6.1 | -41.22 | 2 | 4 | 1 | 35 | 265.377 | 5 | ↓ |
| Mid Mid (pH 6-8) | 1.86 | 7.11 | -121.95 | 3 | 4 | 2 | 40 | 266.385 | 5 | ↓ |
