| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 26th, 2004 | 14 | No |
Popular Name: 3-[(3R,6R)-4-keto-1,3,6-trimethyl-piperidin-1-ium-3-yl]propionitrile 3-[(3R,6R)-4-keto-1,3,6-trimethy…
| 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) | 0.32 | 6.61 | -47.58 | 1 | 3 | 1 | 45 | 195.286 | 2 | ↓ |
| Hi High (pH 8-9.5) | 0.32 | 4.54 | -7.15 | 0 | 3 | 0 | 44 | 194.278 | 2 | ↓ |
