| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 23rd, 2009 | 18 | No |
Popular Name: (E)-4-[isopropyl(4-pyridylmethyl)amino]-4-oxo-but-2-enoic (E)-4-[isopropyl(4-pyridylmethyl…
| 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) | 0.21 | 5.42 | -52.33 | 0 | 5 | -1 | 73 | 247.274 | 5 | ↓ |
| Lo Low (pH 4.5-6) | 0.21 | 5.86 | -72.72 | 1 | 5 | 0 | 75 | 248.282 | 5 | ↓ |
