| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 6th, 2010 | 17 | Yes |
Popular Name: (1S,8R)-N-(3-imidazol-1-ylpropyl)-2,3,5,6,7,8-hexahydro-1H-pyrrolizin-1-amine (1S,8R)-N-(3-imidazol-1-ylpropyl…
| 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) | 0.59 | 6.02 | -98.36 | 3 | 4 | 2 | 39 | 236.363 | 5 | ↓ |
| Hi High (pH 8-9.5) | 0.59 | 5.51 | -50.5 | 2 | 4 | 1 | 38 | 235.355 | 5 | ↓ |
| Hi High (pH 8-9.5) | 0.59 | 4.33 | -7.14 | 1 | 4 | 0 | 33 | 234.347 | 5 | ↓ |
| Mid Mid (pH 6-8) | 0.59 | 8.01 | -118.17 | 3 | 4 | 2 | 39 | 236.363 | 5 | ↓ |
| Mid Mid (pH 6-8) | 0.59 | 7.37 | -74 | 3 | 4 | 2 | 36 | 236.363 | 5 | ↓ |
| Mid Mid (pH 6-8) | 0.59 | 6.85 | -38.24 | 2 | 4 | 1 | 34 | 235.355 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
