| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 24th, 2008 | 21 | Yes |
Popular Name: (1S)-1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-[(2R)-2-methyl-1-piperidyl]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) | 0.47 | 6.79 | -38.82 | 3 | 4 | 1 | 49 | 291.415 | 3 | ↓ |
| Mid Mid (pH 6-8) | 0.47 | 7.03 | -129.18 | 4 | 4 | 2 | 51 | 292.423 | 3 | ↓ |
