| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 6th, 2010 | 19 | Yes |
Popular Name: 2-[[(1S,8aR)-1,2,3,5,6,7,8,8a-octahydroindolizin-1-yl]amino]-N-cyclopropyl-N-ethyl-acetamide 2-[[(1S,8aR)-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) | 1.23 | 7.5 | -110.95 | 3 | 4 | 2 | 41 | 267.417 | 5 | ↓ |
| Hi High (pH 8-9.5) | 1.23 | 6.43 | -36.19 | 2 | 4 | 1 | 37 | 266.409 | 5 | ↓ |
| Hi High (pH 8-9.5) | 1.23 | 4.17 | -6.7 | 1 | 4 | 0 | 36 | 265.401 | 5 | ↓ |
| Hi High (pH 8-9.5) | 1.23 | 5.24 | -41.29 | 2 | 4 | 1 | 40 | 266.409 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
