In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 11th, 2009 | 17 | Yes |
Popular Name: (2R)-N-[(1R)-1-(4-pyridyl)ethyl]piperidine-2-carboxamide (2R)-N-[(1R)-1-(4-pyridyl)ethyl]…
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) | 0.77 | 3.78 | -39.92 | 3 | 4 | 1 | 59 | 234.323 | 3 | ↓ |
Hi High (pH 8-9.5) | 0.77 | 2.41 | -8.06 | 2 | 4 | 0 | 54 | 233.315 | 3 | ↓ |
Lo Low (pH 4.5-6) | 0.77 | 4.24 | -85.9 | 4 | 4 | 2 | 60 | 235.331 | 3 | ↓ |