7-[(2Z)-2-hydroxyimino-2-phenylethoxy]-4-phenylchromen-2-one
Formula:C23H17NO4
Mutagenic:none
Tumorigenic:none
Reproductive Effective:high
7-[(2Z)-2-hydroxyimino-2-phenylethoxy]-4-phenylchromen-2-one is a drug-like molecule.
| MolName | 7-[(2Z)-2-hydroxyimino-2-phenylethoxy]-4-phenylchromen-2-one |
| MolecularFormula | C23H17NO4 |
| Smiles | O/N=C(\COc(cc1)cc(O2)c1C(c1ccccc1)=CC2=O)/c1ccccc1 |
| InChI | InChI=1S/C23H17NO4/c25-23-14-20(16-7-3-1-4-8-16)19-12-11-18(13-22(19)28-23)27-15-21(24-26)17-9-5-2-6-10-17/h1-14,26H,15H2 |
| InChIK | PJEKACSXNQJEAT-UHFFFAOYSA-N |
| TotalMolweight | 371.391 |
| Molweight | 371.391 |
| MonoisotopicMass | 371.115759 |
| CLogP | 4.5068 |
| CLogS | -5.584 |
| H Acceptors | 5 |
| H Donors | 1 |
| TotalSurfaceArea | 284.82 |
| Relative PSA | 0.20241 |
| PolarSurfaceArea | 68.12 |
| Druglikeness | -2.5725 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | high |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.57143 |
| Fragments | 1 |
| Non HAtoms | 28 |
| NonCHAtoms | 5 |
| Electronegative Atoms | 5 |
| Rotatable Bond | 5 |
| Rings Closures | 4 |
| Small Rings | 4 |
| Aromatic Rings | 3 |
| Aromatic Atoms | 18 |
| Sp3Atoms | 4 |
| Symmetricatoms | 4 |
| StereoCon |
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