In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 6th, 2010 | 24 | No |
Popular Name: 2-[2-(2,4-dioxo-1,3,8-triazaspiro[4.5]decan-8-yl)-2-oxo-ethoxy]benzonitrile 2-[2-(2,4-dioxo-1,3,8-triazaspir…
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) | 0.13 | 3.18 | -26.11 | 2 | 8 | 0 | 112 | 328.328 | 3 | ↓ |
Hi High (pH 8-9.5) | 0.32 | 0.55 | -56.17 | 1 | 8 | -1 | 118 | 327.32 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.