In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 13th, 2010 | 18 | Yes |
Popular Name: (3S,4S)-3-[(4aS,8aS)-2,3,4a,5,6,7,8,8a-octahydrobenzo[b][1,4]oxazin-4-yl]heptan-4-amine (3S,4S)-3-[(4aS,8aS)-2,3,4a,5,6,…
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) | 2.74 | 3.98 | -42.35 | 3 | 3 | 1 | 40 | 255.426 | 5 | ↓ |
Mid Mid (pH 6-8) | 2.74 | 5.7 | -122.03 | 4 | 3 | 2 | 41 | 256.434 | 5 | ↓ |