| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 4th, 2008 | 18 | No |
Popular Name: (3Z)-6-methyl-3-[[(6-methyl-2-pyridyl)amino]methylene]pyran-2,4-dione (3Z)-6-methyl-3-[[(6-methyl-2-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) | 1.46 | 5.98 | -50.69 | 0 | 5 | -1 | 79 | 243.242 | 2 | ↓ |
| Lo Low (pH 4.5-6) | 1.46 | 5.2 | -24.27 | 1 | 5 | 0 | 76 | 244.25 | 2 | ↓ |
| Lo Low (pH 4.5-6) | 1.46 | 4.18 | -21.12 | 1 | 5 | 0 | 76 | 244.25 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
