7-[(4-ethenylphenyl)methoxy]-5-hydroxy-2-phenylchromen-4-one
Formula:C24H18O4
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
7-[(4-ethenylphenyl)methoxy]-5-hydroxy-2-phenylchromen-4-one is not a drug-like molecule.
| MolName | 7-[(4-ethenylphenyl)methoxy]-5-hydroxy-2-phenylchromen-4-one |
| MolecularFormula | C24H18O4 |
| Smiles | C=Cc1ccc(COc(cc2O)cc(OC(c3ccccc3)=C3)c2C3=O)cc1 |
| InChI | InChI=1S/C24H18O4/c1-2-16-8-10-17(11-9-16)15-27-19-12-20(25)24-21(26)14-22(28-23(24)13-19)18-6-4-3-5-7-18/h2-14,25H,1,15H2 |
| InChIK | CLCAOWVPPHNIER-UHFFFAOYSA-N |
| TotalMolweight | 370.403 |
| Molweight | 370.403 |
| MonoisotopicMass | 370.12051 |
| CLogP | 5.0781 |
| CLogS | -5.594 |
| H Acceptors | 4 |
| H Donors | 1 |
| TotalSurfaceArea | 286.39 |
| Relative PSA | 0.16111 |
| PolarSurfaceArea | 55.76 |
| Druglikeness | -2.5835 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | low |
| Nasty Functions | |
| Shape Index | 0.60714 |
| Fragments | 1 |
| Non HAtoms | 28 |
| NonCHAtoms | 4 |
| Electronegative Atoms | 4 |
| Rotatable Bond | 5 |
| Rings Closures | 4 |
| Small Rings | 4 |
| Aromatic Rings | 3 |
| Aromatic Atoms | 18 |
| Sp3Atoms | 4 |
| Symmetricatoms | 4 |
| StereoCon |
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