N'-(2,4-dibromoanilino)benzenecarboximidamide
Formula:C13H11N3Br2
Mutagenic:none
Tumorigenic:none
Reproductive Effective:low
N'-(2,4-dibromoanilino)benzenecarboximidamide is not a drug-like molecule.
| MolName | N'-(2,4-dibromoanilino)benzenecarboximidamide |
| MolecularFormula | C13H11N3Br2 |
| Smiles | N/C(/c1ccccc1)=N\Nc(ccc(Br)c1)c1Br |
| InChI | InChI=1S/C13H11Br2N3/c14-10-6-7-12(11(15)8-10)17-18-13(16)9-4-2-1-3-5-9/h1-8,17H,(H2,16,18) |
| InChIK | DRRAXKUXNODSPE-UHFFFAOYSA-N |
| TotalMolweight | 369.059 |
| Molweight | 369.059 |
| MonoisotopicMass | 366.931969 |
| CLogP | 5.4453 |
| CLogS | -4.582 |
| H Acceptors | 3 |
| H Donors | 2 |
| TotalSurfaceArea | 213.23 |
| Relative PSA | 0.17934 |
| PolarSurfaceArea | 50.41 |
| Druglikeness | -0.90728 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | low |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.66667 |
| Fragments | 1 |
| Non HAtoms | 18 |
| NonCHAtoms | 5 |
| Electronegative Atoms | 5 |
| Rotatable Bond | 3 |
| Rings Closures | 2 |
| Small Rings | 2 |
| Aromatic Rings | 2 |
| Aromatic Atoms | 12 |
| Symmetricatoms | 2 |
| BasicNitrogens | 1 |
| StereoCon |
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