| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| June 21st, 2008 | 28 | No |
Popular Name: 2-[1-(2-methoxyanilino)pentylidene]-5-phenyl-1,3-cyclohexanedione 2-[1-(2-methoxyanilino)pentylide…
| 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) | 5.66 | 11.96 | -14.29 | 0 | 4 | 0 | 62 | 376.476 | 7 | ↓ |
| Mid Mid (pH 6-8) | 5.12 | 12.32 | -7.68 | 1 | 4 | 0 | 55 | 377.484 | 7 | ↓ |
| Lo Low (pH 4.5-6) | 5.66 | 9.86 | -11.98 | 1 | 4 | 0 | 59 | 377.484 | 7 | ↓ |
| Lo Low (pH 4.5-6) | 5.66 | 10.29 | -28.13 | 2 | 4 | 1 | 61 | 378.492 | 7 | ↓ |
| Lo Low (pH 4.5-6) | 5.66 | 9.79 | -10.26 | 1 | 4 | 0 | 59 | 377.484 | 7 | ↓ |
| Lo Low (pH 4.5-6) | 5.66 | 9.87 | -10.78 | 1 | 4 | 0 | 59 | 377.484 | 7 | ↓ |
| Lo Low (pH 4.5-6) | 5.66 | 9.84 | -10.61 | 1 | 4 | 0 | 59 | 377.484 | 7 | ↓ |
