| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 24th, 2004 | 20 | Yes |
Popular Name: dimethyl-[3-[3-[(6-methylnicotinoyl)amino]propylammonio]propyl]ammonium dimethyl-[3-[3-[(6-methylnicotin…
| 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) | -0.05 | 5.38 | -111.98 | 4 | 5 | 2 | 63 | 280.416 | 9 | ↓ |
| Hi High (pH 8-9.5) | -0.05 | 4.03 | -40.71 | 3 | 5 | 1 | 58 | 279.408 | 9 | ↓ |
| Mid Mid (pH 6-8) | -0.05 | 2.91 | -49.97 | 3 | 5 | 1 | 62 | 279.408 | 9 | ↓ |
