| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 20th, 2010 | 21 | No |
Popular Name: 2-methylsulfonyl-N-[2-[4-(2-pyridyl)piperazin-1-yl]ethyl]ethanamine 2-methylsulfonyl-N-[2-[4-(2-pyri…
| 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) | -0.13 | 2.58 | -96.91 | 3 | 6 | 2 | 71 | 314.455 | 7 | ↓ |
| Hi High (pH 8-9.5) | -0.13 | 0.91 | -15.53 | 1 | 6 | 0 | 66 | 312.439 | 7 | ↓ |
| Mid Mid (pH 6-8) | -0.13 | 2.26 | -59.33 | 2 | 6 | 1 | 70 | 313.447 | 7 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
