N-[(Z)-[(3Z)-2-phenyl-3-(phenylhydrazinylidene)inden-1-ylidene]amino]aniline
Formula:C27H22N4
Mutagenic:none
Tumorigenic:high
Reproductive Effective:none
N-[(Z)-[(3Z)-2-phenyl-3-(phenylhydrazinylidene)inden-1-ylidene]amino]aniline is not a drug-like molecule.
| MolName | N-[(Z)-[(3Z)-2-phenyl-3-(phenylhydrazinylidene)inden-1-ylidene]amino]aniline |
| MolecularFormula | C27H22N4 |
| Smiles | c1ccc(C(/C(/c2c3cccc2)=N/Nc2ccccc2)/C3=N/Nc2ccccc2)cc1 |
| InChI | InChI=1S/C27H22N4/c1-4-12-20(13-5-1)25-26(30-28-21-14-6-2-7-15-21)23-18-10-11-19-24(23)27(25)31-29-22-16-8-3-9-17-22/h1-19,25,28-29H |
| InChIK | MXKDSUFJUNEGCV-UHFFFAOYSA-N |
| TotalMolweight | 402.5 |
| Molweight | 402.5 |
| MonoisotopicMass | 402.184446 |
| CLogP | 9.6132 |
| CLogS | -6.451 |
| H Acceptors | 4 |
| H Donors | 2 |
| TotalSurfaceArea | 320.4 |
| Relative PSA | 0.14338 |
| PolarSurfaceArea | 48.78 |
| Druglikeness | 1.6157 |
| Mutagenic | none |
| Tumorigenic | high |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.48387 |
| Fragments | 1 |
| Non HAtoms | 31 |
| NonCHAtoms | 4 |
| Electronegative Atoms | 4 |
| Rotatable Bond | 5 |
| Rings Closures | 5 |
| Small Rings | 5 |
| Aromatic Rings | 4 |
| Aromatic Atoms | 24 |
| Sp3Atoms | 1 |
| Symmetricatoms | 16 |
| StereoCon |
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