In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 21st, 2010 | 19 | Yes |
Popular Name: 2-cyclohexylidene-N-([1,2,4]triazolo[4,3-a]pyridin-3-yl)acetamide 2-cyclohexylidene-N-([1,2,4]tria…
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) | 2.64 | 10.3 | -21.07 | 1 | 5 | 0 | 59 | 256.309 | 2 | ↓ |
Hi High (pH 8-9.5) | 2.83 | 9.56 | -60.84 | 0 | 5 | -1 | 66 | 255.301 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.