In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 13th, 2010 | 20 | Yes |
Popular Name: 4-[[(4aS,8aS)-2,3,4a,5,6,7,8,8a-octahydrobenzo[b][1,4]oxazin-4-yl]sulfonyl]phenol 4-[[(4aS,8aS)-2,3,4a,5,6,7,8,8a-…
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) | 2.01 | 1.72 | -8.92 | 1 | 5 | 0 | 67 | 297.376 | 2 | ↓ |
Hi High (pH 8-9.5) | 2.01 | 2.49 | -43.82 | 0 | 5 | -1 | 70 | 296.368 | 2 | ↓ |