| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 25th, 2009 | 23 | No |
Popular Name: (E)-4-oxo-4-[[(1S)-1-phenylethyl]-(4-pyridylmethyl)amino]but-2-enoic (E)-4-oxo-4-[[(1S)-1-phenylethyl…
| 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) | 1.50 | 7.93 | -52.65 | 0 | 5 | -1 | 73 | 309.345 | 6 | ↓ |
| Lo Low (pH 4.5-6) | 1.50 | 8.36 | -69.99 | 1 | 5 | 0 | 75 | 310.353 | 6 | ↓ |
