In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 10th, 2010 | 15 | No |
Popular Name: [5-[(1-oxo-1,4-thiazinan-4-yl)methyl]isoxazol-3-yl]methanamine [5-[(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) | -1.25 | 0.52 | -124.67 | 4 | 5 | 2 | 75 | 231.321 | 3 | ↓ |
Hi High (pH 8-9.5) | -1.25 | -1.58 | -63.5 | 3 | 5 | 1 | 74 | 230.313 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.