| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 23rd, 2009 | 18 | No |
Popular Name: N-[(3S)-3-methyl-1,1-dioxo-thiolan-3-yl]-1-prop-2-ynyl-piperidin-4-amine N-[(3S)-3-methyl-1,1-dioxo-thiol…
| 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) | 0.64 | 1.23 | -54.3 | 2 | 4 | 1 | 54 | 271.406 | 3 | ↓ |
| Hi High (pH 8-9.5) | 0.64 | 0.54 | -12.07 | 1 | 4 | 0 | 49 | 270.398 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
