| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 14th, 2011 | 15 | No |
Popular Name: N-[[2-(methylsulfonylmethyl)-1H-imidazol-4-yl]methyl]cyclopropanamine N-[[2-(methylsulfonylmethyl)-1H-…
| 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 | 0.77 | -43.77 | 3 | 5 | 1 | 79 | 230.313 | 5 | ↓ |
| Hi High (pH 8-9.5) | -0.44 | 0.32 | -41.79 | 2 | 5 | 0 | 78 | 229.305 | 5 | ↓ |
| Hi High (pH 8-9.5) | -0.44 | -0.55 | -17.3 | 2 | 5 | 0 | 75 | 229.305 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
