In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 13th, 2010 | 21 | Yes |
Popular Name: (1S,2S)-2-[(4aS,8aS)-2,3,4a,5,6,7,8,8a-octahydrobenzo[b][1,4]oxazin-4-yl]tetralin-1-amine (1S,2S)-2-[(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) | 1.19 | 4.98 | -44.65 | 3 | 3 | 1 | 40 | 287.427 | 1 | ↓ |
Mid Mid (pH 6-8) | 1.19 | 6.71 | -34.26 | 3 | 3 | 1 | 40 | 287.427 | 1 | ↓ |
Lo Low (pH 4.5-6) | 1.19 | 7.01 | -128.72 | 4 | 3 | 2 | 41 | 288.435 | 1 | ↓ |