In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 27th, 2010 | 19 | Yes |
Popular Name: 3-[(4aS,7aS)-3,4a,5,6,7,7a-hexahydro-2H-cyclopenta[b][1,4]oxazin-4-yl]-1-phenyl-propan-1-one 3-[(4aS,7aS)-3,4a,5,6,7,7a-hexah…
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) | 2.49 | 5.91 | -7.91 | 0 | 3 | 0 | 30 | 259.349 | 4 | ↓ |
Mid Mid (pH 6-8) | 2.49 | 8.13 | -42.17 | 1 | 3 | 1 | 31 | 260.357 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.