| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 6th, 2010 | 19 | Yes |
Popular Name: 2-[[4-[(1S,8aR)-1,2,3,5,6,7,8,8a-octahydroindolizin-1-yl]-1,2,4-triazol-3-yl]sulfanyl]acetic 2-[[4-[(1S,8aR)-1,2,3,5,6,7,8,8a…
| 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) | 0.67 | 9.45 | -70.78 | 1 | 6 | 0 | 75 | 282.369 | 4 | ↓ |
| Hi High (pH 8-9.5) | 0.67 | 7.3 | -45.79 | 0 | 6 | -1 | 74 | 281.361 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
