| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 22nd, 2010 | 18 | No |
Popular Name: (3S)-N-[2-(2-isopropylimidazol-1-yl)ethyl]-1,1-dioxo-thiolan-3-amine (3S)-N-[2-(2-isopropylimidazol-1…
| 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) | 0.44 | 2.81 | -41.57 | 2 | 5 | 1 | 65 | 272.394 | 5 | ↓ |
| Mid Mid (pH 6-8) | 0.44 | 3.96 | -126.64 | 3 | 5 | 2 | 70 | 273.402 | 5 | ↓ |
| Mid Mid (pH 6-8) | 0.44 | 3.48 | -74.24 | 2 | 5 | 1 | 69 | 272.394 | 5 | ↓ |
| Mid Mid (pH 6-8) | 0.44 | 2.33 | -16.66 | 1 | 5 | 0 | 64 | 271.386 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
