| MolName | (3E)-2-phenyl-3-[(2-phenyl-1H-indol-3-yl)methylidene]indole |
| MolecularFormula | C29H20N2 |
| Smiles | C(c1c(-c2ccccc2)[nH]c2c1cccc2)=C1/C(c2ccccc2)=Nc2c1cccc2 |
| InChI | InChI=1S/C29H20N2/c1-3-11-20(12-4-1)28-24(22-15-7-9-17-26(22)30-28)19-25-23-16-8-10-18-27(23)31-29(25)21-13-5-2-6-14-21/h1-19,30H |
| InChIK | IRNHHRKKOZTSJB-UHFFFAOYSA-N |
| TotalMolweight | 396.492 |
| Molweight | 396.492 |
| MonoisotopicMass | 396.162648 |
| CLogP | 6.3348 |
| CLogS | -7.232 |
| H Acceptors | 2 |
| H Donors | 1 |
| TotalSurfaceArea | 310.89 |
| Relative PSA | 0.082023 |
| PolarSurfaceArea | 28.15 |
| Druglikeness | 1.2002 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | high |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.41935 |
| Fragments | 1 |
| Non HAtoms | 31 |
| NonCHAtoms | 2 |
| Electronegative Atoms | 2 |
| Rotatable Bond | 3 |
| Rings Closures | 6 |
| Small Rings | 6 |
| Aromatic Rings | 5 |
| Aromatic Atoms | 27 |
| Symmetricatoms | 4 |
| Aromatic Nitrogens | 1 |
| StereoCon |
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1 - (3E)-2-phenyl-3-[(2-phenyl-1H-indol-3-yl)methylidene]indole | 2 - (3E)-2-phenyl-3-[(2-phenyl-1H-indol-3-yl)methylidene]indole