In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 6th, 2010 | 20 | Yes |
Popular Name: N-[1-(2-amino-2-oxo-ethyl)-4-piperidyl]-2-(4-aminopyrazol-1-yl)acetamide N-[1-(2-amino-2-oxo-ethyl)-4-pip…
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) | -1.94 | -0.99 | -49.86 | 6 | 8 | 1 | 120 | 281.34 | 5 | ↓ |
Hi High (pH 8-9.5) | -1.94 | -3.19 | -18.79 | 5 | 8 | 0 | 119 | 280.332 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.