| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 19th, 2010 | 19 | Yes |
Popular Name: 2-[[[(8S)-8-bicyclo[4.2.0]octa-1(6),2,4-trienyl]methylamino]methyl]-6-bromo-phenol 2-[[[(8S)-8-bicyclo[4.2.0]octa-1…
| 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) | 3.58 | 6.06 | -6.63 | 2 | 2 | 0 | 32 | 318.214 | 4 | ↓ |
| Hi High (pH 8-9.5) | 3.58 | 6.82 | -44.15 | 1 | 2 | -1 | 35 | 317.206 | 4 | ↓ |
| Hi High (pH 8-9.5) | 3.58 | 8.21 | -36.69 | 2 | 2 | 0 | 40 | 318.214 | 4 | ↓ |
| Mid Mid (pH 6-8) | 3.58 | 7.46 | -46.72 | 3 | 2 | 1 | 37 | 319.222 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
![Bicyclo[4.2.0]octa-1(6),2,4-triene](http://zinc12.docking.org/img/rings/5474.gif)
![Benzyl(7-bicyclo[4.2.0]octa-1(6),2,4-trienylmethyl)amine](http://zinc12.docking.org/img/rings/540599.gif)