| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 27th, 2009 | 21 | Yes |
Popular Name: 2-[cyclopropyl-[(5,6-dimethyl-4-oxo-1H-thieno[2,3-d]pyrimidin-2-yl)methyl]amino]acetic 2-[cyclopropyl-[(5,6-dimethyl-4-…
| 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) | -0.05 | 7.8 | -44.82 | 2 | 6 | 0 | 90 | 307.375 | 5 | ↓ |
| Hi High (pH 8-9.5) | 0.41 | 5.17 | -54.96 | 1 | 6 | -1 | 93 | 306.367 | 5 | ↓ |
| Hi High (pH 8-9.5) | -0.05 | 5.75 | -47.9 | 1 | 6 | -1 | 89 | 306.367 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
![3H-thieno[2,3-d]pyrimidin-4-one](http://zinc12.docking.org/img/rings/3143.gif)
![2-[(cyclopropylamino)methyl]-3H-thieno[2,3-d]pyrimidin-4-one](http://zinc12.docking.org/img/rings/74828.gif)