In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 2nd, 2009 | 21 | Yes |
Popular Name: 4-[(4aR,8aR)-2,3,4a,5,6,7,8,8a-octahydrobenzo[b][1,4]oxazin-4-yl]-2,2-diethyl-4-oxo-butanoic 4-[(4aR,8aR)-2,3,4a,5,6,7,8,8a-o…
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) | 2.24 | 7.73 | -59.47 | 0 | 5 | -1 | 70 | 296.387 | 5 | ↓ |
Lo Low (pH 4.5-6) | 2.24 | 5.44 | -5.7 | 1 | 5 | 0 | 67 | 297.395 | 5 | ↓ |