| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 2nd, 2010 | 23 | Yes |
Popular Name: 4-[(3,4-dihydro-2H-1,5-benzodioxepin-6-ylmethylamino)methyl]-N,N-dimethyl-aniline 4-[(3,4-dihydro-2H-1,5-benzodiox…
| 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) | 2.95 | 8.65 | -42.3 | 2 | 4 | 1 | 38 | 313.421 | 5 | ↓ |
| Hi High (pH 8-9.5) | 2.95 | 7.28 | -8.22 | 1 | 4 | 0 | 34 | 312.413 | 5 | ↓ |
