| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 18th, 2011 | 18 | No |
Popular Name: (1R,5S)-3-(1,2,3,4-tetrahydroisoquinolin-7-yl)-3-azabicyclo[3.1.0]hexane-2,4-dione (1R,5S)-3-(1,2,3,4-tetrahydroiso…
| 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) | 1.17 | 4.53 | -12.41 | 1 | 4 | 0 | 49 | 242.278 | 1 | ↓ |
| Mid Mid (pH 6-8) | 1.17 | 5.89 | -50.1 | 2 | 4 | 1 | 54 | 243.286 | 1 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
![3-azabicyclo[3.1.0]hexane-2,4-quinone](http://zinc12.docking.org/img/rings/30292.gif)
![3-(1,2,3,4-tetrahydroisoquinolin-7-yl)-3-azabicyclo[3.1.0]hexane-2,4-quinone](http://zinc12.docking.org/img/rings/265184.gif)