| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 13th, 2004 | 29 | No |
Popular Name: (5E)-5-[4-(diethylamino)benzylidene]-1-(4-ethylphenyl)barbituric-acid (5E)-5-[4-(diethylamino)benzylid…
| 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) | 3.86 | 8.26 | -50.1 | 0 | 6 | -1 | 78 | 390.463 | 6 | ↓ |
| Mid Mid (pH 6-8) | 3.40 | 10.74 | -9.48 | 1 | 6 | 0 | 75 | 391.471 | 6 | ↓ |
| Mid Mid (pH 6-8) | 3.86 | 8.4 | -57.77 | 1 | 6 | 0 | 79 | 391.471 | 6 | ↓ |
| Lo Low (pH 4.5-6) | 3.40 | 10.85 | -40.94 | 2 | 6 | 0 | 76 | 392.479 | 6 | ↓ |
