(E)-2-hydroxy-2-phenylethenediazonium
Formula:C8H7N2O
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
(E)-2-hydroxy-2-phenylethenediazonium is a drug-like molecule.
| MolName | (E)-2-hydroxy-2-phenylethenediazonium |
| MolecularFormula | C8H7N2O |
| Smiles | N#[N+]/C=C(\c1ccccc1)/O |
| InChI | InChI=1S/C8H6N2O/c9-10-6-8(11)7-4-2-1-3-5-7/h1-6H/p+1 |
| InChIK | ZSTBZBURMWJKSQ-UHFFFAOYSA-O |
| TotalMolweight | 147.157 |
| Molweight | 147.157 |
| MonoisotopicMass | 147.055838 |
| CLogP | 0.7447 |
| CLogS | -1.838 |
| H Acceptors | 3 |
| H Donors | 1 |
| TotalSurfaceArea | 128.89 |
| Relative PSA | 0.34463 |
| PolarSurfaceArea | 48.38 |
| Druglikeness | -3.4046 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.72727 |
| Fragments | 1 |
| Non HAtoms | 11 |
| NonCHAtoms | 3 |
| Electronegative Atoms | 3 |
| Rotatable Bond | 1 |
| Rings Closures | 1 |
| Small Rings | 1 |
| Aromatic Rings | 1 |
| Aromatic Atoms | 6 |
| Sp3Atoms | 1 |
| Symmetricatoms | 2 |
| StereoCon |
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1 - (E)-2-hydroxy-2-phenylethenediazonium | 2 - (E)-2-hydroxy-2-phenylethenediazonium
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