Chemical Name - melamine
Mol Weight - 126.123
Smiles - Nc1nc(N)nc(N)n1
Mol Weight - 126.123
Smiles - Nc1nc(N)nc(N)n1
| Property Value | |
| Mol Name | melamine |
| Molweight | 126.123 |
| Monoisotopic Mass | 126.065394 |
| Clogp | -0.9507 |
| Clogs | -2.03 |
| H Acceptors | 6 |
| H Donors | 3 |
| Total Surface Area | 95.1 |
| Relative Psa | 0.82776 |
| Polar Surface Area | 116.73 |
| Druglikeness | -1.9084 |
| Mutagenic | high |
| Tumorigenic | high |
| Reproductive Effective | high |
| Irritant | high |
| Shape Index | 0.55556 |
| Molecular Complexity | 0.65976 |
| Fragments | 1 |
| Non H Atoms | 9 |
| Non Ch Atoms | 6 |
| Electronegative Atoms | 6 |
| Rings Closures | 1 |
| Small Rings | 1 |
| Aromatic Rings | 1 |
| Aromatic Atoms | 6 |
| Symmetric Atoms | 6 |
| Aromatic Nitrogens | 3 |
| Basic Nitrogens | 3 |
| Smiles | Nc1nc(N)nc(N)n1 |
| InChIKey | InChI=1S/C3H6N6/c4-1-7-2(5)9-3(6)8-1/h(H6,4,5,6,7,8,9) |
| InChI | JDSHMPZPIAZGSV-UHFFFAOYSA-N |
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1 - melamine
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