7-[(2,4-difluorophenyl)methoxy]-5-hydroxy-2-phenylchromen-4-one
Formula:C22H14O4F2
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
7-[(2,4-difluorophenyl)methoxy]-5-hydroxy-2-phenylchromen-4-one is a drug-like molecule.
| MolName | 7-[(2,4-difluorophenyl)methoxy]-5-hydroxy-2-phenylchromen-4-one |
| MolecularFormula | C22H14O4F2 |
| Smiles | Oc1cc(OCc(ccc(F)c2)c2F)cc(OC(c2ccccc2)=C2)c1C2=O |
| InChI | InChI=1S/C22H14F2O4/c23-15-7-6-14(17(24)8-15)12-27-16-9-18(25)22-19(26)11-20(28-21(22)10-16)13-4-2-1-3-5-13/h1-11,25H,12H2 |
| InChIK | OFJVOJUVNTXSNN-UHFFFAOYSA-N |
| TotalMolweight | 380.345 |
| Molweight | 380.345 |
| MonoisotopicMass | 380.086016 |
| CLogP | 4.5768 |
| CLogS | -5.417 |
| H Acceptors | 4 |
| H Donors | 1 |
| TotalSurfaceArea | 274.55 |
| Relative PSA | 0.16806 |
| PolarSurfaceArea | 55.76 |
| Druglikeness | -1.2335 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.57143 |
| Fragments | 1 |
| Non HAtoms | 28 |
| NonCHAtoms | 6 |
| Electronegative Atoms | 6 |
| Rotatable Bond | 4 |
| Rings Closures | 4 |
| Small Rings | 4 |
| Aromatic Rings | 3 |
| Aromatic Atoms | 18 |
| Sp3Atoms | 4 |
| Symmetricatoms | 2 |
| StereoCon |
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1 - 7-[(2,4-difluorophenyl)methoxy]-5-hydroxy-2-phenylchromen-4-one | 2 - 7-[(2,4-difluorophenyl)methoxy]-5-hydroxy-2-phenylchromen-4-one
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