| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 6th, 2010 | 17 | Yes |
Popular Name: (1S,8aR)-N-[(1-methylimidazol-2-yl)methyl]-1,2,3,5,6,7,8,8a-octahydroindolizin-1-amine (1S,8aR)-N-[(1-methylimidazol-2-…
| 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) | 0.70 | 7.01 | -113.19 | 3 | 4 | 2 | 39 | 236.363 | 3 | ↓ |
| Hi High (pH 8-9.5) | 0.70 | 5.86 | -38.51 | 2 | 4 | 1 | 34 | 235.355 | 3 | ↓ |
| Hi High (pH 8-9.5) | 0.70 | 3.6 | -7.46 | 1 | 4 | 0 | 33 | 234.347 | 3 | ↓ |
| Mid Mid (pH 6-8) | 0.70 | 7.46 | -199.75 | 4 | 4 | 3 | 40 | 237.371 | 3 | ↓ |
| Mid Mid (pH 6-8) | 0.70 | 6.31 | -78.76 | 3 | 4 | 2 | 36 | 236.363 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
