| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 6th, 2010 | 17 | No |
Popular Name: (3R,4S)-4-[[(1R,8R)-2,3,5,6,7,8-hexahydro-1H-pyrrolizin-1-yl]amino]-1,1-dioxo-thiolan-3-ol (3R,4S)-4-[[(1R,8R)-2,3,5,6,7,8-…
| 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) | -0.76 | -0.72 | -43.95 | 3 | 5 | 1 | 71 | 261.367 | 2 | ↓ |
| Hi High (pH 8-9.5) | -0.76 | 0.65 | -82.04 | 3 | 5 | 1 | 78 | 261.367 | 2 | ↓ |
| Hi High (pH 8-9.5) | -0.76 | -3.23 | -11.6 | 2 | 5 | 0 | 70 | 260.359 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
