Mol Weight - 140.146
Smiles - Cc1nc(OC)nc(N)n1
InChI - NXFQWRWXEYTOTK-UHFFFAOYSA-N
InChIKey - InChI=1S/C5H8N4O/c1-3-7-4(6)9-5(8-3)10-2/h1-2H3,(H2,6,7,8,9)
| Property Name | Property Value |
| Mol Name | 2-Amino-4-methoxy-6-methyl-1,3,5-triazine |
| Molweight | 140.146 |
| Monoisotopic Mass | 140.069811 |
| Clogp | 0.1978 |
| Clogs | -1.253 |
| H Acceptors | 5 |
| H Donors | 1 |
| Total Surface Area | 112.58 |
| Relative Psa | 0.51679 |
| Polar Surface Area | 73.92 |
| Druglikeness | -1.7702 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | high |
| Shape Index | 0.6 |
| Molecular Flexibility | 0.26123 |
| Molecular Complexity | 0.65917 |
| Fragments | 1 |
| Non H Atoms | 10 |
| Non Ch Atoms | 5 |
| Electronegative Atoms | 5 |
| Rotatable Bonds | 1 |
| Rings Closures | 1 |
| Small Rings | 1 |
| Aromatic Rings | 1 |
| Aromatic Atoms | 6 |
| Sp3 Atoms | 3 |
| Aromatic Nitrogens | 3 |
| Smiles | Cc1nc(OC)nc(N)n1 |
| InChIKey | InChI=1S/C5H8N4O/c1-3-7-4(6)9-5(8-3)10-2/h1-2H3,(H2,6,7,8,9) |
| InChI | NXFQWRWXEYTOTK-UHFFFAOYSA-N |
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1 — 2-Amino-4-methoxy-6-methyl-1,3,5-triazine | 2 — 2-Amino-4-methoxy-6-methyl-1,3,5-triazine