In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 13th, 2010 | 18 | Yes |
Popular Name: 1-[4-[3-(aminomethyl)-6-methyl-2-pyridyl]piperazin-1-yl]ethanone 1-[4-[3-(aminomethyl)-6-methyl-2…
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) | -0.42 | 4.34 | -112.72 | 4 | 5 | 2 | 65 | 250.346 | 2 | ↓ |
Mid Mid (pH 6-8) | -0.42 | 3.88 | -56.54 | 3 | 5 | 1 | 64 | 249.338 | 2 | ↓ |