4-[(E)-N-[(E)-[(4-aminophenyl)-phenylmethylidene]amino]-C-phenylcarbonimidoyl]aniline
Formula:C26H22N4
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
4-[(E)-N-[(E)-[(4-aminophenyl)-phenylmethylidene]amino]-C-phenylcarbonimidoyl]aniline is not a drug-like molecule.
| MolName | 4-[(E)-N-[(E)-[(4-aminophenyl)-phenylmethylidene]amino]-C-phenylcarbonimidoyl]aniline |
| MolecularFormula | C26H22N4 |
| Smiles | Nc(cc1)ccc1/C(/c1ccccc1)=N/N=C(\c1ccccc1)/c(cc1)ccc1N |
| InChI | InChI=1S/C26H22N4/c27-23-15-11-21(12-16-23)25(19-7-3-1-4-8-19)29-30-26(20-9-5-2-6-10-20)22-13-17-24(28)18-14-22/h1-18H,27-28H2 |
| InChIK | KUZMMZJVOVUSFZ-UHFFFAOYSA-N |
| TotalMolweight | 390.489 |
| Molweight | 390.489 |
| MonoisotopicMass | 390.184446 |
| CLogP | 5.8244 |
| CLogS | -7.836 |
| H Acceptors | 4 |
| H Donors | 2 |
| TotalSurfaceArea | 315.52 |
| Relative PSA | 0.16975 |
| PolarSurfaceArea | 76.76 |
| Druglikeness | 0.4225 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | dimethylene-hydrazine |
| Shape Index | 0.46667 |
| Fragments | 1 |
| Non HAtoms | 30 |
| NonCHAtoms | 4 |
| Electronegative Atoms | 4 |
| Rotatable Bond | 5 |
| Rings Closures | 4 |
| Small Rings | 4 |
| Aromatic Rings | 4 |
| Aromatic Atoms | 24 |
| Symmetricatoms | 19 |
| Amines | 2 |
| Aromatic Amines | 2 |
| StereoCon |
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