2-[(E)-2-(3-phenylmethoxyphenyl)ethenyl]quinolin-8-ol
Formula:C24H19NO2
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
2-[(E)-2-(3-phenylmethoxyphenyl)ethenyl]quinolin-8-ol is not a drug-like molecule.
| MolName | 2-[(E)-2-(3-phenylmethoxyphenyl)ethenyl]quinolin-8-ol |
| MolecularFormula | C24H19NO2 |
| Smiles | Oc1c2nc(/C=C/c3cccc(OCc4ccccc4)c3)ccc2ccc1 |
| InChI | InChI=1S/C24H19NO2/c26-23-11-5-9-20-13-15-21(25-24(20)23)14-12-18-8-4-10-22(16-18)27-17-19-6-2-1-3-7-19/h1-16,26H,17H2 |
| InChIK | KBDAQCVTRXYKRT-UHFFFAOYSA-N |
| TotalMolweight | 353.42 |
| Molweight | 353.42 |
| MonoisotopicMass | 353.141579 |
| CLogP | 5.239 |
| CLogS | -5.527 |
| H Acceptors | 3 |
| H Donors | 1 |
| TotalSurfaceArea | 282.75 |
| Relative PSA | 0.1205 |
| PolarSurfaceArea | 42.35 |
| Druglikeness | -1.5855 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.62963 |
| Fragments | 1 |
| Non HAtoms | 27 |
| NonCHAtoms | 3 |
| Electronegative Atoms | 3 |
| Rotatable Bond | 5 |
| Rings Closures | 4 |
| Small Rings | 4 |
| Aromatic Rings | 4 |
| Aromatic Atoms | 22 |
| Sp3Atoms | 3 |
| Symmetricatoms | 2 |
| Aromatic Nitrogens | 1 |
| StereoCon |
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