(Z)-3-(N-hydroxyanilino)-2-phenylprop-2-enoic acid
Formula:C15H13NO3
Mutagenic:low
Tumorigenic:low
Reproductive Effective:none
(Z)-3-(N-hydroxyanilino)-2-phenylprop-2-enoic acid is a drug-like molecule.
| MolName | (Z)-3-(N-hydroxyanilino)-2-phenylprop-2-enoic acid |
| MolecularFormula | C15H13NO3 |
| Smiles | OC(/C(/c1ccccc1)=C\N(c1ccccc1)O)=O |
| InChI | InChI=1S/C15H13NO3/c17-15(18)14(12-7-3-1-4-8-12)11-16(19)13-9-5-2-6-10-13/h1-11,19H,(H,17,18) |
| InChIK | VGVFZAALQOGWSF-UHFFFAOYSA-N |
| TotalMolweight | 255.272 |
| Molweight | 255.272 |
| MonoisotopicMass | 255.089544 |
| CLogP | 1.6572 |
| CLogS | -2.388 |
| H Acceptors | 4 |
| H Donors | 2 |
| TotalSurfaceArea | 198.48 |
| Relative PSA | 0.21559 |
| PolarSurfaceArea | 60.77 |
| Druglikeness | 0.63177 |
| Mutagenic | low |
| Tumorigenic | low |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.57895 |
| Fragments | 1 |
| Non HAtoms | 19 |
| NonCHAtoms | 4 |
| Electronegative Atoms | 4 |
| Rotatable Bond | 4 |
| Rings Closures | 2 |
| Small Rings | 2 |
| Aromatic Rings | 2 |
| Aromatic Atoms | 12 |
| Sp3Atoms | 3 |
| Symmetricatoms | 4 |
| AcidicOxygens | 1 |
| StereoCon |
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