2-[(E)-[naphthalen-2-yl(phenyl)methylidene]amino]guanidine
Formula:C18H16N4
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
2-[(E)-[naphthalen-2-yl(phenyl)methylidene]amino]guanidine is a drug-like molecule.
| MolName | 2-[(E)-[naphthalen-2-yl(phenyl)methylidene]amino]guanidine |
| MolecularFormula | C18H16N4 |
| Smiles | NC(N)=N/N=C(\c1ccccc1)/c1cc2ccccc2cc1 |
| InChI | InChI=1S/C18H16N4/c19-18(20)22-21-17(14-7-2-1-3-8-14)16-11-10-13-6-4-5-9-15(13)12-16/h1-12H,(H4,19,20,22) |
| InChIK | LSKFOYAABMIESU-UHFFFAOYSA-N |
| TotalMolweight | 288.353 |
| Molweight | 288.353 |
| MonoisotopicMass | 288.137496 |
| CLogP | 4.2644 |
| CLogS | -6.372 |
| H Acceptors | 4 |
| H Donors | 2 |
| TotalSurfaceArea | 230.6 |
| Relative PSA | 0.23226 |
| PolarSurfaceArea | 76.76 |
| Druglikeness | 0.44927 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | dimethylene-hydrazine |
| Shape Index | 0.5 |
| Fragments | 1 |
| Non HAtoms | 22 |
| NonCHAtoms | 4 |
| Electronegative Atoms | 4 |
| Rotatable Bond | 3 |
| Rings Closures | 3 |
| Small Rings | 3 |
| Aromatic Rings | 3 |
| Aromatic Atoms | 16 |
| Symmetricatoms | 3 |
| BasicNitrogens | 1 |
| StereoCon |
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1 - 2-[(E)-[naphthalen-2-yl(phenyl)methylidene]amino]guanidine | 2 - 2-[(E)-[naphthalen-2-yl(phenyl)methylidene]amino]guanidine
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