(NE)-4-(4-azidosulfonylphenoxy)-N-diazobenzenesulfonamide
Formula:C12H8N6O5S2
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
(NE)-4-(4-azidosulfonylphenoxy)-N-diazobenzenesulfonamide is not a drug-like molecule.
| MolName | (NE)-4-(4-azidosulfonylphenoxy)-N-diazobenzenesulfonamide |
| MolecularFormula | C12H8N6O5S2 |
| Smiles | [N-]=[N+]=NS(c(cc1)ccc1Oc(cc1)ccc1S(N=[N+]=[N-])(=O)=O)(=O)=O |
| InChI | InChI=1S/C12H8N6O5S2/c13-15-17-24(19,20)11-5-1-9(2-6-11)23-10-3-7-12(8-4-10)25(21,22)18-16-14/h1-8H |
| InChIK | VGPBSDQELAMFAH-UHFFFAOYSA-N |
| TotalMolweight | 380.365 |
| Molweight | 380.365 |
| MonoisotopicMass | 379.999759 |
| CLogP | 1.1782 |
| CLogS | -1.905 |
| H Acceptors | 11 |
| TotalSurfaceArea | 261.46 |
| Relative PSA | 0.54287 |
| PolarSurfaceArea | 146.19 |
| Druglikeness | -0.30127 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.68 |
| Fragments | 1 |
| Non HAtoms | 25 |
| NonCHAtoms | 13 |
| Electronegative Atoms | 13 |
| Rotatable Bond | 4 |
| Rings Closures | 2 |
| Small Rings | 2 |
| Aromatic Rings | 2 |
| Aromatic Atoms | 12 |
| Sp3Atoms | 3 |
| Symmetricatoms | 15 |
| StereoCon |
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