2-phenyl-N'-pyridin-2-ylethanimidamide
Formula:C13H13N3
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
2-phenyl-N'-pyridin-2-ylethanimidamide is a drug-like molecule.
| MolName | 2-phenyl-N'-pyridin-2-ylethanimidamide |
| MolecularFormula | C13H13N3 |
| Smiles | N/C(/Cc1ccccc1)=N\c1ncccc1 |
| InChI | InChI=1S/C13H13N3/c14-12(10-11-6-2-1-3-7-11)16-13-8-4-5-9-15-13/h1-9H,10H2,(H2,14,15,16) |
| InChIK | UIJDIXBOBBHOQG-UHFFFAOYSA-N |
| TotalMolweight | 211.267 |
| Molweight | 211.267 |
| MonoisotopicMass | 211.110947 |
| CLogP | 1.536 |
| CLogS | -2.618 |
| H Acceptors | 3 |
| H Donors | 1 |
| TotalSurfaceArea | 177.03 |
| Relative PSA | 0.21324 |
| PolarSurfaceArea | 51.27 |
| Druglikeness | -1.0768 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.6875 |
| Fragments | 1 |
| Non HAtoms | 16 |
| NonCHAtoms | 3 |
| Electronegative Atoms | 3 |
| Rotatable Bond | 3 |
| Rings Closures | 2 |
| Small Rings | 2 |
| Aromatic Rings | 2 |
| Aromatic Atoms | 12 |
| Sp3Atoms | 1 |
| Symmetricatoms | 2 |
| Aromatic Nitrogens | 1 |
| BasicNitrogens | 1 |
| StereoCon |
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1 - 2-phenyl-N'-pyridin-2-ylethanimidamide | 2 - 2-phenyl-N'-pyridin-2-ylethanimidamide
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