| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 5th, 2010 | 36 | 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) | 1.43 | 10.32 | -80.36 | 2 | 9 | 1 | 101 | 495.552 | 10 | ↓ |
| Mid Mid (pH 6-8) | 1.43 | 8.05 | -31.44 | 1 | 9 | 0 | 99 | 494.544 | 10 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
![N-benzyl-2-[6-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-4-keto-pyran-3-yl]oxy-acetamide](http://zinc12.docking.org/img/rings/582237.gif)