| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 24th, 2009 | 19 | No |
Popular Name: (E)-4-[[(1S)-1-methylpropyl]-(2-pyridylmethyl)amino]-4-oxo-but-2-enoic (E)-4-[[(1S)-1-methylpropyl]-(2-…
| 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) | 0.87 | 7.18 | -48.8 | 0 | 5 | -1 | 73 | 261.301 | 6 | ↓ |
| Lo Low (pH 4.5-6) | 0.87 | 7.3 | -67.24 | 1 | 5 | 0 | 75 | 262.309 | 6 | ↓ |
