| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 14th, 2010 | 18 | Yes |
Popular Name: N2-[(1S,8aR)-1,2,3,5,6,7,8,8a-octahydroindolizin-1-yl]-3-methyl-pyridine-2,5-diamine N2-[(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) | 1.97 | 5.78 | -32.84 | 4 | 4 | 1 | 55 | 247.366 | 2 | ↓ |
| Hi High (pH 8-9.5) | 1.97 | 3.65 | -4.7 | 3 | 4 | 0 | 54 | 246.358 | 2 | ↓ |
| Mid Mid (pH 6-8) | 1.97 | 6.13 | -83.29 | 5 | 4 | 2 | 57 | 248.374 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
