| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 10th, 2010 | 36 | Yes |
None
| 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) | 1.42 | 5.65 | -41.23 | 4 | 9 | 1 | 121 | 509.664 | 5 | ↓ |
| Mid Mid (pH 6-8) | 1.42 | 3.26 | -10.25 | 3 | 9 | 0 | 120 | 508.656 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
![2,3,4a,5,6,6a,7,8,9,10,10a,10b-dodecahydrobenzo[f]chromen-1-one](http://zinc12.docking.org/img/rings/94280.gif)
![2-piperazinoacetic Acid (1-keto-2,3,4a,5,6,6a,7,8,9,10,10a,10b-dodecahydrobenzo[f]chromen-5-yl) Ester](http://zinc12.docking.org/img/rings/515980.gif)