In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 13th, 2010 | 19 | Yes |
Popular Name: 3-[[(4aS,8aS)-2,3,4a,5,6,7,8,8a-octahydrobenzo[b][1,4]oxazin-4-yl]methyl]-4-chloro-aniline 3-[[(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) | 2.66 | 4.41 | -3.72 | 2 | 3 | 0 | 38 | 280.799 | 2 | ↓ |
Lo Low (pH 4.5-6) | 2.66 | 6.59 | -29.71 | 3 | 3 | 1 | 40 | 281.807 | 2 | ↓ |