| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 25th, 2008 | 27 | No |
Popular Name: 2-[1-(2-methoxyanilino)butylidene]-5-phenyl-1,3-cyclohexanedione 2-[1-(2-methoxyanilino)butyliden…
| 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) | 5.16 | 11.18 | -14.34 | 0 | 4 | 0 | 62 | 362.449 | 6 | ↓ |
| Mid Mid (pH 6-8) | 4.62 | 11.55 | -7.79 | 1 | 4 | 0 | 55 | 363.457 | 6 | ↓ |
| Lo Low (pH 4.5-6) | 5.16 | 9.5 | -27.87 | 2 | 4 | 1 | 61 | 364.465 | 6 | ↓ |
| Lo Low (pH 4.5-6) | 5.16 | 9.11 | -10.78 | 1 | 4 | 0 | 59 | 363.457 | 6 | ↓ |
| Lo Low (pH 4.5-6) | 5.16 | 9.08 | -12.18 | 1 | 4 | 0 | 59 | 363.457 | 6 | ↓ |
| Lo Low (pH 4.5-6) | 5.16 | 9.01 | -10.34 | 1 | 4 | 0 | 59 | 363.457 | 6 | ↓ |
| Lo Low (pH 4.5-6) | 5.16 | 9.06 | -10.71 | 1 | 4 | 0 | 59 | 363.457 | 6 | ↓ |
