(7E)-7-(fluoranthen-2-ylmethylidene)benzo[c]fluorene
Formula:C34H20
Mutagenic:high
Tumorigenic:high
Reproductive Effective:high
(7E)-7-(fluoranthen-2-ylmethylidene)benzo[c]fluorene is not a drug-like molecule.
| MolName | (7E)-7-(fluoranthen-2-ylmethylidene)benzo[c]fluorene |
| MolecularFormula | C34H20 |
| Smiles | C(c1cc2cccc(-c3c-4cccc3)c2c4c1)=C(\c1c-2cccc1)/c1c2c2ccccc2cc1 |
| InChI | InChI=1S/C34H20/c1-2-10-24-22(8-1)16-17-30-31(27-13-5-6-14-29(27)34(24)30)19-21-18-23-9-7-15-28-25-11-3-4-12-26(25)32(20-21)33(23)28/h1-20H |
| InChIK | KBGHTAZKYDRVMS-UHFFFAOYSA-N |
| TotalMolweight | 428.533 |
| Molweight | 428.533 |
| MonoisotopicMass | 428.1565 |
| CLogP | 9.3485 |
| CLogS | -12.255 |
| TotalSurfaceArea | 319.45 |
| Druglikeness | -0.76608 |
| Mutagenic | high |
| Tumorigenic | high |
| Reproductive Effective | high |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.44118 |
| Fragments | 1 |
| Non HAtoms | 34 |
| Rotatable Bond | 1 |
| Rings Closures | 8 |
| Small Rings | 8 |
| Aromatic Rings | 6 |
| Aromatic Atoms | 32 |
| StereoCon |
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