(Z)-1-(4-phenylmethoxyphenyl)-N-quinazolin-4-yloxymethanimine
Formula:C22H17N3O2
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
(Z)-1-(4-phenylmethoxyphenyl)-N-quinazolin-4-yloxymethanimine is not a drug-like molecule.
| MolName | (Z)-1-(4-phenylmethoxyphenyl)-N-quinazolin-4-yloxymethanimine |
| MolecularFormula | C22H17N3O2 |
| Smiles | C(c1ccccc1)Oc1ccc(/C=N\Oc2ncnc3ccccc23)cc1 |
| InChI | InChI=1S/C22H17N3O2/c1-2-6-18(7-3-1)15-26-19-12-10-17(11-13-19)14-25-27-22-20-8-4-5-9-21(20)23-16-24-22/h1-14,16H,15H2 |
| InChIK | LOYKHGAQNMQADG-UHFFFAOYSA-N |
| TotalMolweight | 355.396 |
| Molweight | 355.396 |
| MonoisotopicMass | 355.132077 |
| CLogP | 5.1499 |
| CLogS | -6.748 |
| H Acceptors | 5 |
| TotalSurfaceArea | 283.42 |
| Relative PSA | 0.18859 |
| PolarSurfaceArea | 56.6 |
| Druglikeness | -0.49212 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.66667 |
| Fragments | 1 |
| Non HAtoms | 27 |
| NonCHAtoms | 5 |
| Electronegative Atoms | 5 |
| Rotatable Bond | 6 |
| Rings Closures | 4 |
| Small Rings | 4 |
| Aromatic Rings | 4 |
| Aromatic Atoms | 22 |
| Sp3Atoms | 3 |
| Symmetricatoms | 4 |
| Aromatic Nitrogens | 2 |
| StereoCon |
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