(Z)-N-oxido-1-(4-phenylthiadiazol-5-yl)methanimine
Formula:C9H6N3OS
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
(Z)-N-oxido-1-(4-phenylthiadiazol-5-yl)methanimine is a drug-like molecule.
| MolName | (Z)-N-oxido-1-(4-phenylthiadiazol-5-yl)methanimine |
| MolecularFormula | C9H6N3OS |
| Smiles | [O-]/N=C\c1c(-c2ccccc2)nns1 |
| InChI | InChI=1S/C9H7N3OS/c13-10-6-8-9(11-12-14-8)7-4-2-1-3-5-7/h1-6,13H/p-1 |
| InChIK | OOXKLBANBDAIPJ-UHFFFAOYSA-M |
| TotalMolweight | 204.233 |
| Molweight | 204.233 |
| MonoisotopicMass | 204.023157 |
| CLogP | 2.794 |
| CLogS | -3.84 |
| H Acceptors | 4 |
| TotalSurfaceArea | 158.77 |
| Relative PSA | 0.42886 |
| PolarSurfaceArea | 89.44 |
| Druglikeness | -3.0587 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.64286 |
| Fragments | 1 |
| Non HAtoms | 14 |
| NonCHAtoms | 5 |
| Electronegative Atoms | 5 |
| Rotatable Bond | 2 |
| Rings Closures | 2 |
| Small Rings | 2 |
| Aromatic Rings | 2 |
| Aromatic Atoms | 11 |
| Sp3Atoms | 1 |
| Symmetricatoms | 2 |
| Aromatic Nitrogens | 2 |
| StereoCon |
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