In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 18th, 2009 | 22 | Yes |
Popular Name: (5R)-3-(5-phenoxy-3-pyridyl)-3,6-diazaspiro[4.4]nonane (5R)-3-(5-phenoxy-3-pyridyl)-3,6…
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) | 3.25 | 7.1 | -44.68 | 2 | 4 | 1 | 42 | 296.394 | 3 | ↓ |
Hi High (pH 8-9.5) | 3.25 | 5.92 | -5.99 | 1 | 4 | 0 | 37 | 295.386 | 3 | ↓ |
Lo Low (pH 4.5-6) | 3.25 | 7.58 | -89.76 | 3 | 4 | 2 | 43 | 297.402 | 3 | ↓ |