| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 24th, 2009 | 16 | Yes |
Popular Name: (5S)-7,8-difluoro-1,1-dioxo-2,3,4,5-tetrahydrobenzo[b]thiepin-5-amine (5S)-7,8-difluoro-1,1-dioxo-2,3,…
| 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) | -0.68 | 1.13 | -66.06 | 3 | 3 | 1 | 62 | 248.274 | 0 | ↓ |
| Mid Mid (pH 6-8) | -0.68 | 1.49 | -11.36 | 2 | 3 | 0 | 60 | 247.266 | 0 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
![2,3,4,5-tetrahydrobenzo[b]thiepine 1,1-dioxide](http://zinc12.docking.org/img/rings/221873.gif)