| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 21st, 2009 | 21 | Yes |
Popular Name: (1S)-1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-N'-methyl-N'-pentyl-ethane-1,2-diamine (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) | 1.18 | 7.35 | -38.83 | 3 | 4 | 1 | 49 | 293.431 | 7 | ↓ |
| Mid Mid (pH 6-8) | 1.18 | 7.72 | -137.82 | 4 | 4 | 2 | 51 | 294.439 | 7 | ↓ |
