2,4-difluoro-N-[(Z)-2-(1-phenyltetrazol-5-yl)ethylideneamino]aniline
Formula:C15H12N6F2
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
2,4-difluoro-N-[(Z)-2-(1-phenyltetrazol-5-yl)ethylideneamino]aniline is a drug-like molecule.
| MolName | 2,4-difluoro-N-[(Z)-2-(1-phenyltetrazol-5-yl)ethylideneamino]aniline |
| MolecularFormula | C15H12N6F2 |
| Smiles | Fc(cc1)cc(F)c1N/N=C\Cc1nnnn1-c1ccccc1 |
| InChI | InChI=1S/C15H12F2N6/c16-11-6-7-14(13(17)10-11)19-18-9-8-15-20-21-22-23(15)12-4-2-1-3-5-12/h1-7,9-10,19H,8H2 |
| InChIK | RDIZUWNOCFCTBL-UHFFFAOYSA-N |
| TotalMolweight | 314.298 |
| Molweight | 314.298 |
| MonoisotopicMass | 314.10915 |
| CLogP | 3.5178 |
| CLogS | -3.247 |
| H Acceptors | 6 |
| H Donors | 1 |
| TotalSurfaceArea | 240.94 |
| Relative PSA | 0.26044 |
| PolarSurfaceArea | 67.99 |
| Druglikeness | 0.44352 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | imine/hydrazone of aldehyde |
| Shape Index | 0.65217 |
| Fragments | 1 |
| Non HAtoms | 23 |
| NonCHAtoms | 8 |
| Electronegative Atoms | 8 |
| Rotatable Bond | 5 |
| Rings Closures | 3 |
| Small Rings | 3 |
| Aromatic Rings | 3 |
| Aromatic Atoms | 17 |
| Sp3Atoms | 1 |
| Symmetricatoms | 2 |
| Aromatic Nitrogens | 4 |
| StereoCon |
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