In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 13th, 2010 | 18 | Yes |
Popular Name: 2-[(2R)-2-(hydroxymethyl)-1-piperidyl]-6-methyl-pyridine-3-carboxamidine 2-[(2R)-2-(hydroxymethyl)-1-pipe…
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) | -0.20 | 1.81 | -36.92 | 5 | 5 | 1 | 88 | 249.338 | 3 | ↓ |
Mid Mid (pH 6-8) | -0.20 | 3.17 | -8.23 | 4 | 5 | 0 | 86 | 248.33 | 3 | ↓ |
Lo Low (pH 4.5-6) | -0.20 | 2.24 | -89.06 | 6 | 5 | 2 | 89 | 250.346 | 3 | ↓ |