In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 19th, 2010 | 18 | Yes |
Popular Name: (Z)-3-cyclopropyl-N-([1,2,4]triazolo[4,3-a]pyridin-3-yl)but-2-enamide (Z)-3-cyclopropyl-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) | 2.20 | 9.86 | -22.02 | 1 | 5 | 0 | 59 | 242.282 | 3 | ↓ |
Hi High (pH 8-9.5) | 2.39 | 9.02 | -61.72 | 0 | 5 | -1 | 66 | 241.274 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.