9-[(E)-3-(2-chlorophenyl)prop-2-enylidene]fluorene
Formula:C22H15Cl
Mutagenic:high
Tumorigenic:high
Reproductive Effective:high
9-[(E)-3-(2-chlorophenyl)prop-2-enylidene]fluorene is not a drug-like molecule.
| MolName | 9-[(E)-3-(2-chlorophenyl)prop-2-enylidene]fluorene |
| MolecularFormula | C22H15Cl |
| Smiles | Clc1c(/C=C/C=C2c(cccc3)c3-c3c2cccc3)cccc1 |
| InChI | InChI=1S/C22H15Cl/c23-22-15-6-1-8-16(22)9-7-14-21-19-12-4-2-10-17(19)18-11-3-5-13-20(18)21/h1-15H |
| InChIK | VPBIMQYLYAKIAR-UHFFFAOYSA-N |
| TotalMolweight | 314.814 |
| Molweight | 314.814 |
| MonoisotopicMass | 314.086227 |
| CLogP | 6.5635 |
| CLogS | -7.005 |
| TotalSurfaceArea | 245.91 |
| Druglikeness | -0.35319 |
| Mutagenic | high |
| Tumorigenic | high |
| Reproductive Effective | high |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.52174 |
| Fragments | 1 |
| Non HAtoms | 23 |
| NonCHAtoms | 1 |
| Electronegative Atoms | 1 |
| Rotatable Bond | 2 |
| Rings Closures | 4 |
| Small Rings | 4 |
| Aromatic Rings | 3 |
| Aromatic Atoms | 18 |
| Symmetricatoms | 6 |
| StereoCon |
Click to Load Molecule:
1 - 9-[(E)-3-(2-chlorophenyl)prop-2-enylidene]fluorene | 2 - 9-[(E)-3-(2-chlorophenyl)prop-2-enylidene]fluorene
Spacefill |
Wire |
Ball & Stick |
Iso-vdw |
Opaque |
Dot Surface |
Mep |
Translucent |
Spin |
Label On |
Off