| MolName | (E)-1-(4-aminophenyl)-3-[4-[(E)-3-(4-aminophenyl)-3-oxoprop-1-enyl]phenyl]prop-2-en-1-one |
| MolecularFormula | C24H20N2O2 |
| Smiles | Nc(cc1)ccc1C(/C=C/c1ccc(/C=C/C(c(cc2)ccc2N)=O)cc1)=O |
| InChI | InChI=1S/C24H20N2O2/c25-21-11-7-19(8-12-21)23(27)15-5-17-1-2-18(4-3-17)6-16-24(28)20-9-13-22(26)14-10-20/h1-16H,25-26H2 |
| InChIK | OCWPMDYEIVIALX-UHFFFAOYSA-N |
| TotalMolweight | 368.435 |
| Molweight | 368.435 |
| MonoisotopicMass | 368.152478 |
| CLogP | 3.5934 |
| CLogS | -6.216 |
| H Acceptors | 4 |
| H Donors | 2 |
| TotalSurfaceArea | 298.32 |
| Relative PSA | 0.1898 |
| PolarSurfaceArea | 86.18 |
| Druglikeness | 0.27329 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.71429 |
| Fragments | 1 |
| Non HAtoms | 28 |
| NonCHAtoms | 4 |
| Electronegative Atoms | 4 |
| Rotatable Bond | 6 |
| Rings Closures | 3 |
| Small Rings | 3 |
| Aromatic Rings | 3 |
| Aromatic Atoms | 18 |
| Symmetricatoms | 17 |
| Amines | 2 |
| Aromatic Amines | 2 |
| StereoCon |
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1 - (E)-1-(4-aminophenyl)-3-[4-[(E)-3-(4-aminophenyl)-3-oxoprop-1-enyl]phenyl]prop-2-en-1-one | 2 - (E)-1-(4-aminophenyl)-3-[4-[(E)-3-(4-aminophenyl)-3-oxoprop-1-enyl]phenyl]prop-2-en-1-one