(3Z)-6,8-difluoro-3-[(5-thiophen-2-ylthiophen-2-yl)methylidene]chromen-4-one
Formula:C18H10O2F2S2
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
(3Z)-6,8-difluoro-3-[(5-thiophen-2-ylthiophen-2-yl)methylidene]chromen-4-one is not a drug-like molecule.
| MolName | (3Z)-6,8-difluoro-3-[(5-thiophen-2-ylthiophen-2-yl)methylidene]chromen-4-one |
| MolecularFormula | C18H10O2F2S2 |
| Smiles | O=C1c(cc(cc2F)F)c2OC/C1=C/c1ccc(-c2cccs2)s1 |
| InChI | InChI=1S/C18H10F2O2S2/c19-11-7-13-17(21)10(9-22-18(13)14(20)8-11)6-12-3-4-16(24-12)15-2-1-5-23-15/h1-8H,9H2 |
| InChIK | NFHYQATYUYAOJY-UHFFFAOYSA-N |
| TotalMolweight | 360.403 |
| Molweight | 360.403 |
| MonoisotopicMass | 360.009026 |
| CLogP | 5.4138 |
| CLogS | -6.494 |
| H Acceptors | 2 |
| TotalSurfaceArea | 250.08 |
| Relative PSA | 0.25496 |
| PolarSurfaceArea | 82.78 |
| Druglikeness | 1.0868 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.54167 |
| Fragments | 1 |
| Non HAtoms | 24 |
| NonCHAtoms | 6 |
| Electronegative Atoms | 6 |
| Rotatable Bond | 2 |
| Rings Closures | 4 |
| Small Rings | 4 |
| Aromatic Rings | 3 |
| Aromatic Atoms | 16 |
| Sp3Atoms | 2 |
| StereoCon |
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