(2E)-2-phenyl-2-(phenylhydrazinylidene)acetic acid
Formula:C14H12N2O2
Mutagenic:none
Tumorigenic:high
Reproductive Effective:low
(2E)-2-phenyl-2-(phenylhydrazinylidene)acetic acid is a drug-like molecule.
| MolName | (2E)-2-phenyl-2-(phenylhydrazinylidene)acetic acid |
| MolecularFormula | C14H12N2O2 |
| Smiles | OC(/C(/c1ccccc1)=N/Nc1ccccc1)=O |
| InChI | InChI=1S/C14H12N2O2/c17-14(18)13(11-7-3-1-4-8-11)16-15-12-9-5-2-6-10-12/h1-10,15H,(H,17,18) |
| InChIK | BJIRGSLXYCEUMW-UHFFFAOYSA-N |
| TotalMolweight | 240.261 |
| Molweight | 240.261 |
| MonoisotopicMass | 240.089878 |
| CLogP | 3.5025 |
| CLogS | -2.984 |
| H Acceptors | 4 |
| H Donors | 2 |
| TotalSurfaceArea | 191.55 |
| Relative PSA | 0.25638 |
| PolarSurfaceArea | 61.69 |
| Druglikeness | 1.5599 |
| Mutagenic | none |
| Tumorigenic | high |
| Reproductive Effective | low |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.61111 |
| Fragments | 1 |
| Non HAtoms | 18 |
| NonCHAtoms | 4 |
| Electronegative Atoms | 4 |
| Rotatable Bond | 4 |
| Rings Closures | 2 |
| Small Rings | 2 |
| Aromatic Rings | 2 |
| Aromatic Atoms | 12 |
| Sp3Atoms | 1 |
| Symmetricatoms | 4 |
| AcidicOxygens | 1 |
| StereoCon |
Click to Load Molecule:
1 - (2E)-2-phenyl-2-(phenylhydrazinylidene)acetic acid | 2 - (2E)-2-phenyl-2-(phenylhydrazinylidene)acetic acid
Spacefill |
Wire |
Ball & Stick |
Iso-vdw |
Opaque |
Dot Surface |
Mep |
Translucent |
Spin |
Label On |
Off