(9Z)-2-bromo-9-[(2-chlorophenyl)methylidene]fluorene
Formula:C20H12BrCl
Mutagenic:high
Tumorigenic:high
Reproductive Effective:high
(9Z)-2-bromo-9-[(2-chlorophenyl)methylidene]fluorene is not a drug-like molecule.
| MolName | (9Z)-2-bromo-9-[(2-chlorophenyl)methylidene]fluorene |
| MolecularFormula | C20H12BrCl |
| Smiles | Clc1c(/C=C2\c(cc(cc3)Br)c3-c3c2cccc3)cccc1 |
| InChI | InChI=1S/C20H12BrCl/c21-14-9-10-17-15-6-2-3-7-16(15)18(19(17)12-14)11-13-5-1-4-8-20(13)22/h1-12H |
| InChIK | QRRHSQWZGDECJM-UHFFFAOYSA-N |
| TotalMolweight | 367.672 |
| Molweight | 367.672 |
| MonoisotopicMass | 365.981088 |
| CLogP | 6.6321 |
| CLogS | -7.527 |
| TotalSurfaceArea | 238.04 |
| Druglikeness | -2.4606 |
| Mutagenic | high |
| Tumorigenic | high |
| Reproductive Effective | high |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.45455 |
| Fragments | 1 |
| Non HAtoms | 22 |
| NonCHAtoms | 2 |
| Electronegative Atoms | 2 |
| Rotatable Bond | 1 |
| Rings Closures | 4 |
| Small Rings | 4 |
| Aromatic Rings | 3 |
| Aromatic Atoms | 18 |
| StereoCon |
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