In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 10th, 2010 | 16 | No |
Popular Name: [5-[(1,1-dioxo-1,4-thiazinan-4-yl)methyl]isoxazol-3-yl]methanamine [5-[(1,1-dioxo-1,4-thiazinan-4-y…
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) | -0.85 | -0.52 | -124.42 | 4 | 6 | 2 | 92 | 247.32 | 3 | ↓ |
Mid Mid (pH 6-8) | -0.85 | -2.62 | -59.72 | 3 | 6 | 1 | 91 | 246.312 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.