| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 11th, 2011 | 29 | No |
Popular Name: (2S)-2-allylsulfonyl-N-[6-(4-phenylpiperazin-1-yl)-3-pyridyl]propanamide (2S)-2-allylsulfonyl-N-[6-(4-phe…
| 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) | 2.49 | 7.39 | -25.25 | 1 | 7 | 0 | 83 | 414.531 | 7 | ↓ |
| Mid Mid (pH 6-8) | 2.49 | 7.73 | -53.11 | 2 | 7 | 1 | 84 | 415.539 | 7 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
