| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 22nd, 2009 | 36 | 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) | 6.68 | 14.34 | -51.94 | 1 | 5 | -1 | 87 | 495.68 | 7 | ↓ |
| Lo Low (pH 4.5-6) | 6.68 | 12.37 | -10.61 | 2 | 5 | 0 | 84 | 496.688 | 7 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
![2,3,4,5,6,7,8,9,10,11,12,13,14,15,16,17-hexadecahydro-1H-cyclopenta[a]phenanthrene](http://zinc12.docking.org/img/rings/1358.gif)
![Benzoic Acid 2,3,4,5,6,7,8,9,10,11,12,13,14,15,16,17-hexadecahydro-1H-cyclopenta[a]phenanthren-12-yl Ester](http://zinc12.docking.org/img/rings/552736.gif)