| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 19th, 2011 | 17 | No |
Popular Name: (2R)-N-[(3S)-1,1-dioxothian-3-yl]piperazine-2-carboxamide (2R)-N-[(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) | -1.72 | -3.37 | -62.68 | 4 | 6 | 1 | 92 | 262.355 | 2 | ↓ |
| Mid Mid (pH 6-8) | -1.72 | -4.73 | -20.24 | 3 | 6 | 0 | 87 | 261.347 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
