| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 6th, 2010 | 17 | Yes |
Popular Name: 2-[[(1S,8aS)-1,2,3,5,6,7,8,8a-octahydroindolizin-1-yl]amino]-N-cyclopropyl-acetamide 2-[[(1S,8aS)-1,2,3,5,6,7,8,8a-oc…
| 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) | 1.12 | 5.34 | -110.16 | 4 | 4 | 2 | 50 | 239.363 | 4 | ↓ |
| Hi High (pH 8-9.5) | 1.12 | 4.09 | -34.02 | 3 | 4 | 1 | 46 | 238.355 | 4 | ↓ |
| Hi High (pH 8-9.5) | 1.12 | 1.85 | -7.77 | 2 | 4 | 0 | 44 | 237.347 | 4 | ↓ |
| Hi High (pH 8-9.5) | 1.12 | 3.07 | -40.8 | 3 | 4 | 1 | 49 | 238.355 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
