| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 7th, 2010 | 15 | No |
Popular Name: (3R)-N-(1H-imidazol-5-ylmethyl)-3-methyl-1,1-dioxo-thiolan-3-amine (3R)-N-(1H-imidazol-5-ylmethyl)-…
| 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) | -0.31 | 0.36 | -45.84 | 3 | 5 | 1 | 76 | 230.313 | 3 | ↓ |
| Mid Mid (pH 6-8) | -0.31 | -0.1 | -15.48 | 2 | 5 | 0 | 75 | 229.305 | 3 | ↓ |
| Mid Mid (pH 6-8) | -0.31 | 1.02 | -60.32 | 3 | 5 | 1 | 79 | 230.313 | 3 | ↓ |
| Mid Mid (pH 6-8) | -0.31 | -0.13 | -16.16 | 2 | 5 | 0 | 75 | 229.305 | 3 | ↓ |
| Mid Mid (pH 6-8) | -0.31 | 1.06 | -52.89 | 3 | 5 | 1 | 79 | 230.313 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
