Chemical Name - 5-Amino-3-Methyl Isoxazole
Mol Weight - 98.1046
Smiles - Cc1noc(N)c1
Mol Weight - 98.1046
Smiles - Cc1noc(N)c1
| Property Value | |
| Mol Name | 5-Amino-3-Methyl Isoxazole |
| Molweight | 98.1046 |
| Monoisotopic Mass | 98.048013 |
| Clogp | 0.1419 |
| Clogs | -1.682 |
| H Acceptors | 3 |
| H Donors | 1 |
| Total Surface Area | 82.49 |
| Relative Psa | 0.48915 |
| Polar Surface Area | 52.05 |
| Druglikeness | 0.71554 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Shape Index | 0.71429 |
| Molecular Complexity | 0.7993 |
| Fragments | 1 |
| Non H Atoms | 7 |
| Non Ch Atoms | 3 |
| Electronegative Atoms | 3 |
| Rings Closures | 1 |
| Small Rings | 1 |
| Aromatic Rings | 1 |
| Aromatic Atoms | 5 |
| Sp3 Atoms | 1 |
| Aromatic Nitrogens | 1 |
| Smiles | Cc1noc(N)c1 |
| InChIKey | InChI=1S/C4H6N2O/c1-3-2-4(5)7-6-3/h2H,5H2,1H3 |
| InChI | FNXYWHTZDAVRTB-UHFFFAOYSA-N |
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1 - 5-Amino-3-Methyl Isoxazole
2 - 5-Amino-3-Methyl Isoxazole
1 - 5-Amino-3-Methyl Isoxazole
2 - 5-Amino-3-Methyl Isoxazole
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