| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 21st, 2010 | 19 | No |
Popular Name: (3R)-N-(2-isoindolin-2-ylethyl)-1,1-dioxo-thiolan-3-amine (3R)-N-(2-isoindolin-2-ylethyl)-…
| 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) | 0.63 | 3.44 | -52.52 | 2 | 4 | 1 | 51 | 281.401 | 4 | ↓ |
| Hi High (pH 8-9.5) | 0.63 | 0.88 | -12.18 | 1 | 4 | 0 | 49 | 280.393 | 4 | ↓ |
| Mid Mid (pH 6-8) | 0.63 | 4.6 | -153.63 | 3 | 4 | 2 | 55 | 282.409 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 0.63 | 2.04 | -62.95 | 2 | 4 | 1 | 54 | 281.401 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
