In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 24th, 2010 | 19 | Yes |
Popular Name: N-[[(3R)-1-(6-ethylpyrimidin-4-yl)-3-piperidyl]methyl]propan-1-amine N-[[(3R)-1-(6-ethylpyrimidin-4-y…
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) | 2.34 | 9.05 | -42.64 | 2 | 4 | 1 | 46 | 263.409 | 6 | ↓ |
Mid Mid (pH 6-8) | 2.34 | 9.42 | -82.15 | 3 | 4 | 2 | 47 | 264.417 | 6 | ↓ |