| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 2nd, 2009 | 18 | Yes |
Popular Name: (2S)-2-(6-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)-2-(ethylamino)acetonitrile (2S)-2-(6-chloro-3,4-dihydro-2H-…
| 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) | 2.42 | 4.93 | -8.72 | 1 | 4 | 0 | 54 | 266.728 | 3 | ↓ |
| Lo Low (pH 4.5-6) | 2.42 | 6.02 | -51.88 | 2 | 4 | 1 | 59 | 267.736 | 3 | ↓ |
