| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 20th, 2011 | 14 | No |
Popular Name: [(3S)-1,1-dioxo-3-pyrrolidin-1-yl-thiolan-3-yl]methanamine [(3S)-1,1-dioxo-3-pyrrolidin-1-y…
| 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) | -0.86 | -1.65 | -59.03 | 3 | 4 | 1 | 65 | 219.33 | 2 | ↓ |
| Mid Mid (pH 6-8) | -0.86 | -0.08 | -44.29 | 3 | 4 | 1 | 65 | 219.33 | 2 | ↓ |
| Mid Mid (pH 6-8) | -0.86 | -2.01 | -9.99 | 2 | 4 | 0 | 63 | 218.322 | 2 | ↓ |
| Lo Low (pH 4.5-6) | -0.86 | 0.29 | -141.35 | 4 | 4 | 2 | 66 | 220.338 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
