| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 22nd, 2011 | 17 | No |
Popular Name: 3-[1-[(3S)-6-methyl-2,4-dioxo-pyran-3-yl]vinylamino]propanoic 3-[1-[(3S)-6-methyl-2,4-dioxo-py…
| 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) | 0.57 | 3.39 | -105.75 | 0 | 6 | -2 | 106 | 237.211 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 0.57 | 2.54 | -60.24 | 1 | 6 | -1 | 103 | 238.219 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.