| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 23rd, 2009 | 19 | Yes |
Popular Name: (1R,8aR)-N-(1-prop-2-ynyl-4-piperidyl)-1,2,3,5,6,7,8,8a-octahydroindolizin-1-amine (1R,8aR)-N-(1-prop-2-ynyl-4-pipe…
| 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) | 1.72 | 8.26 | -79.48 | 3 | 3 | 2 | 21 | 263.429 | 3 | ↓ |
| Hi High (pH 8-9.5) | 1.72 | 3.74 | -2.62 | 1 | 3 | 0 | 19 | 261.413 | 3 | ↓ |
| Mid Mid (pH 6-8) | 1.72 | 5.98 | -31.4 | 2 | 3 | 1 | 20 | 262.421 | 3 | ↓ |
| Lo Low (pH 4.5-6) | 1.72 | 7.05 | -110.76 | 3 | 3 | 2 | 24 | 263.429 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
