In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 12th, 2010 | 20 | Yes |
Popular Name: (1R,5S)-N-[[(2R)-1,4-dioxan-2-yl]methyl]-7-isopropyl-7-azabicyclo[3.3.1]nonan-9-amine (1R,5S)-N-[[(2R)-1,4-dioxan-2-yl…
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) | 1.93 | 6.71 | -43.08 | 3 | 4 | 0 | 40 | 284.444 | 4 | ↓ |
Hi High (pH 8-9.5) | 1.93 | 5.74 | -2.68 | 2 | 4 | 0 | 35 | 283.436 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.