In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 22nd, 2011 | 15 | Yes |
Popular Name: (3S,4aS,7aR)-3-phenyl-2,3,4,4a,5,6,7,7a-octahydrocyclopenta[b][1,4]oxazine (3S,4aS,7aR)-3-phenyl-2,3,4,4a,5…
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) | 2.41 | 5.72 | -36.92 | 2 | 2 | 1 | 26 | 204.293 | 1 | ↓ |
Hi High (pH 8-9.5) | 2.41 | 4.55 | -3.02 | 1 | 2 | 0 | 21 | 203.285 | 1 | ↓ |
No pre-computed analogs available. Try a structural similarity search.