| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 8th, 2010 | 17 | Yes |
Popular Name: (1S,8aR)-N-(pyrimidin-4-ylmethyl)-1,2,3,5,6,7,8,8a-octahydroindolizin-1-amine (1S,8aR)-N-(pyrimidin-4-ylmethyl…
| 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) | 0.85 | 5.45 | -36.3 | 2 | 4 | 1 | 42 | 233.339 | 3 | ↓ |
| Hi High (pH 8-9.5) | 0.85 | 3.19 | -5.44 | 1 | 4 | 0 | 41 | 232.331 | 3 | ↓ |
| Lo Low (pH 4.5-6) | 0.85 | 6.6 | -113.49 | 3 | 4 | 2 | 47 | 234.347 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
