| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 6th, 2010 | 16 | Yes |
Popular Name: (1S,8R)-N-[(1-methylimidazol-2-yl)methyl]-2,3,5,6,7,8-hexahydro-1H-pyrrolizin-1-amine (1S,8R)-N-[(1-methylimidazol-2-y…
None
| 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) | 0.20 | 6.04 | -111.48 | 3 | 4 | 2 | 39 | 222.336 | 3 | ↓ |
| Hi High (pH 8-9.5) | 0.20 | 4.87 | -38.75 | 2 | 4 | 1 | 34 | 221.328 | 3 | ↓ |
| Hi High (pH 8-9.5) | 0.20 | 2.36 | -7.61 | 1 | 4 | 0 | 33 | 220.32 | 3 | ↓ |
| Mid Mid (pH 6-8) | 0.20 | 5.34 | -78.1 | 3 | 4 | 2 | 36 | 222.336 | 3 | ↓ |
| Mid Mid (pH 6-8) | 0.20 | 6.5 | -196.22 | 4 | 4 | 3 | 40 | 223.344 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
