| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 10th, 2009 | 20 | Yes |
Popular Name: 4-[3-[(1S)-1-(methylamino)ethyl]phenyl]sulfonylpiperazin-2-one 4-[3-[(1S)-1-(methylamino)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) | 0.81 | 1.05 | -50.56 | 3 | 6 | 1 | 83 | 298.388 | 4 | ↓ |
| Hi High (pH 8-9.5) | 0.81 | -0.13 | -12.68 | 2 | 6 | 0 | 79 | 297.38 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
