Mol Weight - 219.284
Smiles - OCCN1CN(CCO)CN(CCO)C1
| Property Name | Property Value |
| Mol Name | Hexahydro-1,3,5-tris(2-hydroxyethyl)-s-triazine |
| Molweight | 219.284 |
| Monoisotopic Mass | 219.158292 |
| Clogp | -1.2492 |
| Clogs | 0.235 |
| H Acceptors | 6 |
| H Donors | 3 |
| Total Surface Area | 173.79 |
| Relative Psa | 0.28742 |
| Polar Surface Area | 70.41 |
| Druglikeness | 2.0936 |
| Mutagenic | high |
| Tumorigenic | high |
| Reproductive Effective | high |
| Irritant | low |
| Shape Index | 0.6 |
| Molecular Flexibility | 0.63072 |
| Molecular Complexity | 0.56718 |
| Fragments | 1 |
| Non H Atoms | 15 |
| Non Ch Atoms | 6 |
| Electronegative Atoms | 6 |
| Rotatable Bonds | 6 |
| Rings Closures | 1 |
| Small Rings | 1 |
| Sp3 Atoms | 15 |
| Symmetric Atoms | 10 |
| Basic Nitrogens | 3 |
| Smiles | OCCN1CN(CCO)CN(CCO)C1 |
| InChIKey | InChI=1S/C9H21N3O3/c13-4-1-10-7-11(2-5-14)9-12(8-10)3-6-15/h13-15H,1-9H2 |
| InChI | HUHGPYXAVBJSJV-UHFFFAOYSA-N |
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1 — Hexahydro-1,3,5-tris(2-hydroxyethyl)-s-triazine | 2 — Hexahydro-1,3,5-tris(2-hydroxyethyl)-s-triazine