In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 13th, 2008 | 17 | Yes |
Popular Name: 1-[4-[3-(aminomethyl)-2-pyridyl]piperazin-1-yl]ethanone 1-[4-[3-(aminomethyl)-2-pyridyl]…
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) | -0.47 | 2.34 | -56.18 | 3 | 5 | 1 | 64 | 235.311 | 2 | ↓ |
Mid Mid (pH 6-8) | -0.47 | 2.79 | -111.98 | 4 | 5 | 2 | 65 | 236.319 | 2 | ↓ |