| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| March 4th, 2011 | 26 | Yes |
Popular Name: (2S)-2-[3-[4-(4-fluorophenyl)piperazin-1-yl]propyl]-2H-1,4-benzothiazine (2S)-2-[3-[4-(4-fluorophenyl)pip…
| 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) | 4.43 | 12.35 | -49.59 | 1 | 3 | 1 | 20 | 370.517 | 5 | ↓ |
| Mid Mid (pH 6-8) | 4.43 | 10.12 | -9.16 | 0 | 3 | 0 | 19 | 369.509 | 5 | ↓ |
| Lo Low (pH 4.5-6) | 4.43 | 12.72 | -103.48 | 2 | 3 | 2 | 22 | 371.525 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
![2-[3-(4-phenylpiperazino)propyl]-2H-1,4-benzothiazine](http://zinc12.docking.org/img/rings/195073.gif)