2-[(E)-2-(2-aminophenyl)ethenyl]quinolin-8-ol
Formula:C17H14N2O
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
2-[(E)-2-(2-aminophenyl)ethenyl]quinolin-8-ol is a drug-like molecule.
| MolName | 2-[(E)-2-(2-aminophenyl)ethenyl]quinolin-8-ol |
| MolecularFormula | C17H14N2O |
| Smiles | Nc1c(/C=C/c2ccc(cccc3O)c3n2)cccc1 |
| InChI | InChI=1S/C17H14N2O/c18-15-6-2-1-4-12(15)8-10-14-11-9-13-5-3-7-16(20)17(13)19-14/h1-11,20H,18H2 |
| InChIK | YOUDUYWZJMYLBJ-UHFFFAOYSA-N |
| TotalMolweight | 262.311 |
| Molweight | 262.311 |
| MonoisotopicMass | 262.110613 |
| CLogP | 3.2136 |
| CLogS | -4.262 |
| H Acceptors | 3 |
| H Donors | 2 |
| TotalSurfaceArea | 207.75 |
| Relative PSA | 0.18936 |
| PolarSurfaceArea | 59.14 |
| Druglikeness | -1.3875 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.6 |
| Fragments | 1 |
| Non HAtoms | 20 |
| NonCHAtoms | 3 |
| Electronegative Atoms | 3 |
| Rotatable Bond | 2 |
| Rings Closures | 3 |
| Small Rings | 3 |
| Aromatic Rings | 3 |
| Aromatic Atoms | 16 |
| Sp3Atoms | 1 |
| Amines | 1 |
| Aromatic Amines | 1 |
| Aromatic Nitrogens | 1 |
| StereoCon |
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