| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 19th, 2011 | 21 | No |
Popular Name: 4-[2-[[(3S)-1,1-dioxothian-3-yl]amino]ethyl]benzenesulfonamide 4-[2-[[(3S)-1,1-dioxothian-3-yl]…
| 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) | 0.39 | -0.59 | -72.23 | 4 | 6 | 1 | 111 | 333.455 | 5 | ↓ |
| Hi High (pH 8-9.5) | 0.39 | -1.77 | -20.18 | 3 | 6 | 0 | 106 | 332.447 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
