In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 2nd, 2011 | 16 | Yes |
Popular Name: (4aS,8aR)-N-ethyl-2,3,4a,5,6,7,8,8a-octahydrobenzo[b][1,4]oxazine-4-sulfonamide (4aS,8aR)-N-ethyl-2,3,4a,5,6,7,8…
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) | 1.09 | 0.78 | -8.46 | 1 | 5 | 0 | 59 | 248.348 | 3 | ↓ |
Hi High (pH 8-9.5) | 1.09 | 0.5 | -41.71 | 0 | 5 | -1 | 61 | 247.34 | 3 | ↓ |