In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 5th, 2011 | 25 | No |
Popular Name: 8-(2-imidazol-1-ylpyridine-4-carbonyl)-1,3,8-triazaspiro[4.5]decane-2,4-dione 8-(2-imidazol-1-ylpyridine-4-car…
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) | -1.21 | 3.54 | -19.45 | 2 | 9 | 0 | 109 | 340.343 | 2 | ↓ |
Hi High (pH 8-9.5) | -1.02 | 0.9 | -48.95 | 1 | 9 | -1 | 116 | 339.335 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.