In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 10th, 2010 | 19 | No |
Popular Name: [3-[(1-oxo-1,4-thiazinan-4-yl)methyl]benzofuran-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) | 0.28 | 1.78 | -58.92 | 3 | 4 | 1 | 61 | 279.385 | 3 | ↓ |
Mid Mid (pH 6-8) | 0.28 | 3.87 | -137.96 | 4 | 4 | 2 | 62 | 280.393 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.