| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 10th, 2010 | 19 | No |
Popular Name: [3-[(1-oxo-1,4-thiazinan-4-yl)methyl]benzothiophen-2-yl]methanamine [3-[(1-oxo-1,4-thiazinan-4-yl)me…
| 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) | 0.92 | 2.6 | -58.64 | 3 | 3 | 1 | 48 | 295.453 | 3 | ↓ |
| Hi High (pH 8-9.5) | 0.92 | 2.21 | -15.01 | 2 | 3 | 0 | 46 | 294.445 | 3 | ↓ |
| Mid Mid (pH 6-8) | 0.92 | 4.68 | -138.73 | 4 | 3 | 2 | 49 | 296.461 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
