Chemical Name - 4,6-Dihydroxypyrimidine
Mol Weight - 112.088
Smiles - Oc1cc(O)ncn1
Mol Weight - 112.088
Smiles - Oc1cc(O)ncn1
| Property Value | |
| Mol Name | 4,6-Dihydroxypyrimidine |
| Molweight | 112.088 |
| Monoisotopic Mass | 112.027278 |
| Clogp | 0.1078 |
| Clogs | -1.07 |
| H Acceptors | 4 |
| H Donors | 2 |
| Total Surface Area | 83.48 |
| Relative Psa | 0.57667 |
| Polar Surface Area | 66.24 |
| Druglikeness | -1.88 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Shape Index | 0.625 |
| Molecular Complexity | 0.67701 |
| Fragments | 1 |
| Non H Atoms | 8 |
| Non Ch Atoms | 4 |
| Electronegative Atoms | 4 |
| Rings Closures | 1 |
| Small Rings | 1 |
| Aromatic Rings | 1 |
| Aromatic Atoms | 6 |
| Sp3 Atoms | 2 |
| Symmetric Atoms | 3 |
| Aromatic Nitrogens | 2 |
| Basic Nitrogens | 2 |
| Smiles | Oc1cc(O)ncn1 |
| InChIKey | InChI=1S/C4H4N2O2/c7-3-1-4(8)6-2-5-3/h1-2H,(H2,5,6,7,8) |
| InChI | DUFGYCAXVIUXIP-UHFFFAOYSA-N |
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1 - 4,6-Dihydroxypyrimidine
2 - 4,6-Dihydroxypyrimidine
1 - 4,6-Dihydroxypyrimidine
2 - 4,6-Dihydroxypyrimidine
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