| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 5th, 2011 | 28 | Yes |
Popular Name: 3-[(2S)-3-(3,4-dihydro-1H-isoquinolin-2-yl)-2-hydroxy-propyl]benzofuro[3,2-d]pyrimidin-4-one 3-[(2S)-3-(3,4-dihydro-1H-isoqui…
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| 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) | 2.25 | 9.46 | -58.99 | 2 | 6 | 1 | 73 | 376.436 | 4 | ↓ |
| Mid Mid (pH 6-8) | 2.25 | 7.15 | -22.11 | 1 | 6 | 0 | 72 | 375.428 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
![3H-benzofuro[3,2-d]pyrimidin-4-one](http://zinc12.docking.org/img/rings/2014.gif)
![3-[3-(3,4-dihydro-1H-isoquinolin-2-yl)propyl]benzofuro[3,2-d]pyrimidin-4-one](http://zinc12.docking.org/img/rings/382997.gif)