2-[(E)-[(2-fluorophenyl)-phenylmethylidene]amino]guanidine
Formula:C14H13N4F
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
2-[(E)-[(2-fluorophenyl)-phenylmethylidene]amino]guanidine is a drug-like molecule.
| MolName | 2-[(E)-[(2-fluorophenyl)-phenylmethylidene]amino]guanidine |
| MolecularFormula | C14H13N4F |
| Smiles | NC(N)=N/N=C(\c1ccccc1)/c(cccc1)c1F |
| InChI | InChI=1S/C14H13FN4/c15-12-9-5-4-8-11(12)13(18-19-14(16)17)10-6-2-1-3-7-10/h1-9H,(H4,16,17,19) |
| InChIK | DMWRNGDOMQODJH-UHFFFAOYSA-N |
| TotalMolweight | 256.283 |
| Molweight | 256.283 |
| MonoisotopicMass | 256.112424 |
| CLogP | 3.1708 |
| CLogS | -5.08 |
| H Acceptors | 4 |
| H Donors | 2 |
| TotalSurfaceArea | 202.35 |
| Relative PSA | 0.26469 |
| PolarSurfaceArea | 76.76 |
| Druglikeness | -0.89073 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | dimethylene-hydrazine |
| Shape Index | 0.47368 |
| Fragments | 1 |
| Non HAtoms | 19 |
| NonCHAtoms | 5 |
| Electronegative Atoms | 5 |
| Rotatable Bond | 3 |
| Rings Closures | 2 |
| Small Rings | 2 |
| Aromatic Rings | 2 |
| Aromatic Atoms | 12 |
| Symmetricatoms | 3 |
| BasicNitrogens | 1 |
| StereoCon |
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1 - 2-[(E)-[(2-fluorophenyl)-phenylmethylidene]amino]guanidine | 2 - 2-[(E)-[(2-fluorophenyl)-phenylmethylidene]amino]guanidine
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