| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| March 28th, 2011 | 29 | No |
Popular Name: [(1S)-2-(1-adamantylcarbamoylamino)-1-methyl-2-oxo-ethyl] [(1S)-2-(1-adamantylcarbamoylami…
| 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) | 4.60 | 8.56 | -20.63 | 3 | 7 | 0 | 105 | 400.475 | 5 | ↓ |
| Hi High (pH 8-9.5) | 4.60 | 9.56 | -61.3 | 2 | 7 | -1 | 108 | 399.467 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
![Benzoic Acid [2-(1-adamantylcarbamoylamino)-2-keto-ethyl] Ester](http://zinc12.docking.org/img/rings/2478.gif)