| MolName | N-[(Z)-3-amino-1-(4-hydroxyphenyl)-3-oxoprop-1-en-2-yl]furan-2-carboxamide |
| MolecularFormula | C14H12N2O4 |
| Smiles | NC(/C(/NC(c1ccco1)=O)=C/c(cc1)ccc1O)=O |
| InChI | InChI=1S/C14H12N2O4/c15-13(18)11(8-9-3-5-10(17)6-4-9)16-14(19)12-2-1-7-20-12/h1-8,17H,(H2,15,18)(H,16,19) |
| InChIK | CRJKJDQGCGRIGN-UHFFFAOYSA-N |
| TotalMolweight | 272.259 |
| Molweight | 272.259 |
| MonoisotopicMass | 272.079708 |
| CLogP | 1.2066 |
| CLogS | -2.836 |
| H Acceptors | 6 |
| H Donors | 3 |
| TotalSurfaceArea | 209.25 |
| Relative PSA | 0.38241 |
| PolarSurfaceArea | 105.56 |
| Druglikeness | 3.1048 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | high |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.6 |
| Fragments | 1 |
| Non HAtoms | 20 |
| NonCHAtoms | 6 |
| Electronegative Atoms | 6 |
| Rotatable Bond | 4 |
| Rings Closures | 2 |
| Small Rings | 2 |
| Aromatic Rings | 2 |
| Aromatic Atoms | 11 |
| Sp3Atoms | 1 |
| Symmetricatoms | 2 |
| Amides | 2 |
| StereoCon |
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1 - N-[(Z)-3-amino-1-(4-hydroxyphenyl)-3-oxoprop-1-en-2-yl]furan-2-carboxamide | 2 - N-[(Z)-3-amino-1-(4-hydroxyphenyl)-3-oxoprop-1-en-2-yl]furan-2-carboxamide