| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 14th, 2008 | 28 | No |
| 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) | 0.14 | 6.98 | -18.1 | 2 | 9 | 0 | 111 | 383.408 | 8 | ↓ |
| Ref Reference (pH 7) | 0.14 | 6.97 | -18.31 | 2 | 9 | 0 | 111 | 383.408 | 8 | ↓ |
| Mid Mid (pH 6-8) | 0.14 | 7.49 | -45.95 | 3 | 9 | 1 | 112 | 384.416 | 8 | ↓ |
| Mid Mid (pH 6-8) | 0.14 | 7.5 | -47.57 | 3 | 9 | 1 | 112 | 384.416 | 8 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
![1-benzyl-5-[(3-imidazol-1-ylpropylamino)methylene]barbituric Acid](http://zinc12.docking.org/img/rings/56570.gif)