| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 27th, 2010 | 16 | No |
Popular Name: (3R)-N-[2-(2-methylimidazol-1-yl)ethyl]-1,1-dioxo-thiolan-3-amine (3R)-N-[2-(2-methylimidazol-1-yl…
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) | -0.61 | 2.91 | -126.74 | 3 | 5 | 2 | 70 | 245.348 | 4 | ↓ |
| Hi High (pH 8-9.5) | -0.61 | 1.72 | -42.02 | 2 | 5 | 1 | 65 | 244.34 | 4 | ↓ |
| Mid Mid (pH 6-8) | -0.61 | 2.43 | -74.12 | 2 | 5 | 1 | 69 | 244.34 | 4 | ↓ |
| Mid Mid (pH 6-8) | -0.61 | 1.25 | -16.88 | 1 | 5 | 0 | 64 | 243.332 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
