N'-(2,4,6-triphenylpyridin-1-ium-1-yl)benzenecarboximidamide
Formula:C30H24N3
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
N'-(2,4,6-triphenylpyridin-1-ium-1-yl)benzenecarboximidamide is not a drug-like molecule.
| MolName | N'-(2,4,6-triphenylpyridin-1-ium-1-yl)benzenecarboximidamide |
| MolecularFormula | C30H24N3 |
| Smiles | N/C(/c1ccccc1)=N/[n+](c(-c1ccccc1)cc(-c1ccccc1)c1)c1-c1ccccc1 |
| InChI | InChI=1S/C30H24N3/c31-30(26-19-11-4-12-20-26)32-33-28(24-15-7-2-8-16-24)21-27(23-13-5-1-6-14-23)22-29(33)25-17-9-3-10-18-25/h1-22H,(H2,31,32)/q+1 |
| InChIK | VOZXSLDARKBOAO-UHFFFAOYSA-N |
| TotalMolweight | 426.542 |
| Molweight | 426.542 |
| MonoisotopicMass | 426.197022 |
| CLogP | 5.6513 |
| CLogS | -9.972 |
| H Acceptors | 3 |
| H Donors | 1 |
| TotalSurfaceArea | 341.09 |
| Relative PSA | 0.086605 |
| PolarSurfaceArea | 42.26 |
| Druglikeness | -1.5775 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.42424 |
| Fragments | 1 |
| Non HAtoms | 33 |
| NonCHAtoms | 3 |
| Electronegative Atoms | 3 |
| Rotatable Bond | 5 |
| Rings Closures | 5 |
| Small Rings | 5 |
| Aromatic Rings | 5 |
| Aromatic Atoms | 30 |
| Symmetricatoms | 14 |
| Aromatic Nitrogens | 1 |
| BasicNitrogens | 1 |
| StereoCon |
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