In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 2nd, 2009 | 19 | Yes |
Popular Name: 2-amino-N-[2-oxo-2-[(3S)-3-(1H-pyrazol-5-yl)-1-piperidyl]ethyl]acetamide 2-amino-N-[2-oxo-2-[(3S)-3-(1H-p…
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) | -1.31 | -0.46 | -50.91 | 5 | 7 | 1 | 106 | 266.325 | 4 | ↓ |
Hi High (pH 8-9.5) | -1.31 | -0.95 | -13.77 | 4 | 7 | 0 | 104 | 265.317 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.