| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 6th, 2011 | 12 | No |
Popular Name: 2-Mercapto-6-methyl-3,5-dihydro-pyrrolo[3,2-d]pyrimidin-4-one 2-Mercapto-6-methyl-3,5-dihydro-…
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CAS Number: 1325303-94-3
6-methyl-2-sulfanylidene-1H,2H,3H,4H,5H-pyrrolo[3,2-d]pyrimidin-4-one
6-methyl-2-thioxo-1,2,3,5-tetrahydro-4H-pyrrolo[3,2-d]pyrimidin-4-one
6-Methyl-2-thioxo-1,2,3,5-tetrahydro-pyrrolo[3,2-d]pyrimidin-4-one
| 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) | 0.66 | -0.18 | -50.2 | 2 | 4 | -1 | 68 | 180.212 | 0 | ↓ |
| Lo Low (pH 4.5-6) | 0.21 | 1.87 | -11.74 | 3 | 4 | 0 | 64 | 181.22 | 0 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
No pre-computed analogs available. Try a structural similarity search.
![1,5-dihydropyrrolo[3,2-d]pyrimidine-2-thione](http://zinc12.docking.org/img/rings/502936.gif)