[(E)-[amino(phenyl)methylidene]amino] 2-phenoxyacetate
Formula:C15H14N2O3
Mutagenic:high
Tumorigenic:none
Reproductive Effective:none
[(E)-[amino(phenyl)methylidene]amino] 2-phenoxyacetate is a drug-like molecule.
| MolName | [(E)-[amino(phenyl)methylidene]amino] 2-phenoxyacetate |
| MolecularFormula | C15H14N2O3 |
| Smiles | N/C(/c1ccccc1)=N/OC(COc1ccccc1)=O |
| InChI | InChI=1S/C15H14N2O3/c16-15(12-7-3-1-4-8-12)17-20-14(18)11-19-13-9-5-2-6-10-13/h1-10H,11H2,(H2,16,17) |
| InChIK | MZWVJPWXNZFGFM-UHFFFAOYSA-N |
| TotalMolweight | 270.287 |
| Molweight | 270.287 |
| MonoisotopicMass | 270.100443 |
| CLogP | 2.647 |
| CLogS | -3.316 |
| H Acceptors | 5 |
| H Donors | 1 |
| TotalSurfaceArea | 216.02 |
| Relative PSA | 0.27692 |
| PolarSurfaceArea | 73.91 |
| Druglikeness | -2.6448 |
| Mutagenic | high |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.7 |
| Fragments | 1 |
| Non HAtoms | 20 |
| NonCHAtoms | 5 |
| Electronegative Atoms | 5 |
| Rotatable Bond | 6 |
| Rings Closures | 2 |
| Small Rings | 2 |
| Aromatic Rings | 2 |
| Aromatic Atoms | 12 |
| Sp3Atoms | 3 |
| Symmetricatoms | 4 |
| StereoCon |
Click to Load Molecule:
1 - [(E)-[amino(phenyl)methylidene]amino] 2-phenoxyacetate | 2 - [(E)-[amino(phenyl)methylidene]amino] 2-phenoxyacetate
Spacefill |
Wire |
Ball & Stick |
Iso-vdw |
Opaque |
Dot Surface |
Mep |
Translucent |
Spin |
Label On |
Off