(Z)-N-[3-(morpholin-4-ylmethyl)phenyl]-2,3-diphenylprop-2-enamide
Formula:C26H26N2O2
Mutagenic:none
Tumorigenic:low
Reproductive Effective:high
(Z)-N-[3-(morpholin-4-ylmethyl)phenyl]-2,3-diphenylprop-2-enamide is a drug-like molecule.
| MolName | (Z)-N-[3-(morpholin-4-ylmethyl)phenyl]-2,3-diphenylprop-2-enamide |
| MolecularFormula | C26H26N2O2 |
| Smiles | O=C(/C(/c1ccccc1)=C\c1ccccc1)Nc1cc(CN2CCOCC2)ccc1 |
| InChI | InChI=1S/C26H26N2O2/c29-26(25(23-11-5-2-6-12-23)19-21-8-3-1-4-9-21)27-24-13-7-10-22(18-24)20-28-14-16-30-17-15-28/h1-13,18-19H,14-17,20H2,(H,27,29) |
| InChIK | ZIZKRLGQUKHJJE-UHFFFAOYSA-N |
| TotalMolweight | 398.504 |
| Molweight | 398.504 |
| MonoisotopicMass | 398.199428 |
| CLogP | 4.065 |
| CLogS | -4.036 |
| H Acceptors | 4 |
| H Donors | 1 |
| TotalSurfaceArea | 322.3 |
| Relative PSA | 0.11806 |
| PolarSurfaceArea | 41.57 |
| Druglikeness | 3.9745 |
| Mutagenic | none |
| Tumorigenic | low |
| Reproductive Effective | high |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.53333 |
| Fragments | 1 |
| Non HAtoms | 30 |
| NonCHAtoms | 4 |
| Electronegative Atoms | 4 |
| Rotatable Bond | 6 |
| Rings Closures | 4 |
| Small Rings | 4 |
| Aromatic Rings | 3 |
| Aromatic Atoms | 18 |
| Sp3Atoms | 7 |
| Symmetricatoms | 6 |
| Amides | 1 |
| Amines | 1 |
| AlkylAmines | 1 |
| BasicNitrogens | 1 |
| StereoCon |
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1 - (Z)-N-[3-(morpholin-4-ylmethyl)phenyl]-2,3-diphenylprop-2-enamide | 2 - (Z)-N-[3-(morpholin-4-ylmethyl)phenyl]-2,3-diphenylprop-2-enamide
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