In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 21st, 2010 | 20 | Yes |
Popular Name: N-[2-[(4aS,8aR)-2,3,4a,5,6,7,8,8a-octahydrobenzo[b][1,4]oxazin-4-yl]ethyl]-2-bromo-aniline N-[2-[(4aS,8aR)-2,3,4a,5,6,7,8,8…
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) | 3.82 | 5.63 | -3.21 | 1 | 3 | 0 | 24 | 339.277 | 4 | ↓ |
Mid Mid (pH 6-8) | 3.82 | 7.84 | -40.13 | 2 | 3 | 1 | 26 | 340.285 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.