| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 10th, 2011 | 22 | No |
Popular Name: N-[2-[methyl-[2-(2-pyridyl)ethyl]amino]-2-oxo-ethyl]thiomorpholine-4-carboxamide N-[2-[methyl-[2-(2-pyridyl)ethyl…
| 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) | 0.92 | 5.82 | -13.1 | 1 | 6 | 0 | 66 | 322.434 | 5 | ↓ |
| Lo Low (pH 4.5-6) | 0.92 | 6.18 | -40.13 | 2 | 6 | 1 | 67 | 323.442 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
![N-[2-keto-2-[2-(2-pyridyl)ethylamino]ethyl]thiomorpholine-4-carboxamide](http://zinc12.docking.org/img/rings/529244.gif)