| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 8th, 2004 | 30 | Yes |
| 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) | 2.94 | -5.25 | -18.81 | 3 | 9 | 0 | 130 | 498.355 | 9 | ↓ |
| Hi High (pH 8-9.5) | 2.94 | -4.81 | -49.18 | 2 | 9 | -1 | 132 | 497.347 | 9 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
![Benzoic Acid [2-[(2-anilino-2-keto-ethyl)amino]-2-keto-ethyl] Ester](http://zinc12.docking.org/img/rings/2473.gif)