[(E)-[amino(phenyl)methylidene]amino] 2-naphthalen-2-yloxyacetate
Formula:C19H16N2O3
Mutagenic:high
Tumorigenic:none
Reproductive Effective:none
[(E)-[amino(phenyl)methylidene]amino] 2-naphthalen-2-yloxyacetate is a drug-like molecule.
| MolName | [(E)-[amino(phenyl)methylidene]amino] 2-naphthalen-2-yloxyacetate |
| MolecularFormula | C19H16N2O3 |
| Smiles | N/C(/c1ccccc1)=N/OC(COc1cc2ccccc2cc1)=O |
| InChI | InChI=1S/C19H16N2O3/c20-19(15-7-2-1-3-8-15)21-24-18(22)13-23-17-11-10-14-6-4-5-9-16(14)12-17/h1-12H,13H2,(H2,20,21) |
| InChIK | CUUJGGQFDNUIPC-UHFFFAOYSA-N |
| TotalMolweight | 320.347 |
| Molweight | 320.347 |
| MonoisotopicMass | 320.116093 |
| CLogP | 3.8414 |
| CLogS | -4.922 |
| H Acceptors | 5 |
| H Donors | 1 |
| TotalSurfaceArea | 250.62 |
| Relative PSA | 0.23869 |
| PolarSurfaceArea | 73.91 |
| Druglikeness | -2.6448 |
| Mutagenic | high |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.66667 |
| Fragments | 1 |
| Non HAtoms | 24 |
| NonCHAtoms | 5 |
| Electronegative Atoms | 5 |
| Rotatable Bond | 6 |
| Rings Closures | 3 |
| Small Rings | 3 |
| Aromatic Rings | 3 |
| Aromatic Atoms | 16 |
| Sp3Atoms | 3 |
| Symmetricatoms | 2 |
| StereoCon |
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