| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 6th, 2008 | 29 | Yes |
Popular Name: N-[2-(4-methylpiperazin-1-yl)ethyl]-2-(5-oxopyrido[2,3-b][1,5]benzothiazepin-6-yl)acetamide N-[2-(4-methylpiperazin-1-yl)eth…
| 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) | 1.76 | 6.38 | -50.71 | 2 | 7 | 1 | 72 | 412.539 | 5 | ↓ |
| Mid Mid (pH 6-8) | 1.76 | 6.25 | -52.26 | 2 | 7 | 1 | 72 | 412.539 | 5 | ↓ |
| Mid Mid (pH 6-8) | 1.76 | 3.91 | -17.52 | 1 | 7 | 0 | 70 | 411.531 | 5 | ↓ |
![6H-pyrido[2,3-b][1,5]benzothiazepin-5-one](http://zinc12.docking.org/img/rings/92600.gif)
![2-(5-ketopyrido[2,3-b][1,5]benzothiazepin-6-yl)-N-(2-piperazinoethyl)acetamide](http://zinc12.docking.org/img/rings/92696.gif)
