| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 19th, 2011 | 18 | No |
Popular Name: (1R,8aS)-N-[(3R)-1,1-dioxothian-3-yl]-1,2,3,5,6,7,8,8a-octahydroindolizin-1-amine (1R,8aS)-N-[(3R)-1,1-dioxothian-…
| 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) | 0.93 | 3.04 | -42.02 | 2 | 4 | 1 | 51 | 273.422 | 2 | ↓ |
| Hi High (pH 8-9.5) | 0.93 | 0.79 | -10.06 | 1 | 4 | 0 | 49 | 272.414 | 2 | ↓ |
| Lo Low (pH 4.5-6) | 0.93 | 4.03 | -127.63 | 3 | 4 | 2 | 55 | 274.43 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
