In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 18th, 2011 | 20 | Yes |
Popular Name: 1-[(1S,6R)-3,9-diazabicyclo[4.2.1]nonan-9-yl]-4-morpholino-butan-1-one 1-[(1S,6R)-3,9-diazabicyclo[4.2.…
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) | 0.02 | 3.57 | -42.54 | 2 | 5 | 1 | 49 | 282.408 | 4 | ↓ |
Mid Mid (pH 6-8) | 0.02 | 5.83 | -92.1 | 3 | 5 | 2 | 51 | 283.416 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.