Atrazine
Representations & DB's id
| ||
| ChEBI: | CHEBI:15930 | |
|---|---|---|
| ChEMBL: | CHEMBL15063 | |
| PubChem: | 2256 | |
| IUPAC: | 6-chloro-4-N-ethyl-2-N-propan-2-yl-1,3,5-triazine-2,4-diamine | |
| Standard InChI: | InChI=1S/C8H14ClN5/c1-4-10-7-12-6(9)13-8(14-7)11-5(2)3/h5H,4H2,1-3H3,(H2,10,11,12,13,14) | |
| Standard InChI Key: | MXWJVTOOROXGIU-UHFFFAOYSA-N | |
| SMILES: | CCN=c1nc(Cl)[nH]c(=NC(C)C)[nH]1 | |
Molecular propeties
| ||
| AlogP: | 1.78 | |
|---|---|---|
| Hydrogen bonds acceptors: | 5 | |
| Hydrogen bonds donors: | 2 | |
| Rotatable bonds: | 4 | |
| Number of rings: | 1 | |
| Molecular Weight: | 215.09 | |
| Topological polar surface area: | 62.7 | |
| Number of aromatic rings: | 1 | |
| Fsp3: | 0.625 | |
| Number of carbons: | 9 | |