(E)-N,N-dibenzyl-2-phenylethenamine
Formula:C22H21N
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
(E)-N,N-dibenzyl-2-phenylethenamine is a drug-like molecule.
| MolName | (E)-N,N-dibenzyl-2-phenylethenamine |
| MolecularFormula | C22H21N |
| Smiles | C(c1ccccc1)N(Cc1ccccc1)/C=C/c1ccccc1 |
| InChI | InChI=1S/C22H21N/c1-4-10-20(11-5-1)16-17-23(18-21-12-6-2-7-13-21)19-22-14-8-3-9-15-22/h1-17H,18-19H2 |
| InChIK | YLABIYTVXBHXSD-UHFFFAOYSA-N |
| TotalMolweight | 299.416 |
| Molweight | 299.416 |
| MonoisotopicMass | 299.167399 |
| CLogP | 4.4313 |
| CLogS | -4.475 |
| H Acceptors | 1 |
| TotalSurfaceArea | 257.1 |
| Relative PSA | 0.013808 |
| PolarSurfaceArea | 3.24 |
| Druglikeness | 2.1154 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.52174 |
| Fragments | 1 |
| Non HAtoms | 23 |
| NonCHAtoms | 1 |
| Electronegative Atoms | 1 |
| Rotatable Bond | 6 |
| Rings Closures | 3 |
| Small Rings | 3 |
| Aromatic Rings | 3 |
| Aromatic Atoms | 18 |
| Sp3Atoms | 3 |
| Symmetricatoms | 11 |
| BasicNitrogens | 1 |
| StereoCon |
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1 - (E)-N,N-dibenzyl-2-phenylethenamine | 2 - (E)-N,N-dibenzyl-2-phenylethenamine
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