2,4-diphenyl-5-[(E)-2-phenylethenyl]-3,4-dihydropyrazole
Formula:C23H20N2
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
2,4-diphenyl-5-[(E)-2-phenylethenyl]-3,4-dihydropyrazole is not a drug-like molecule.
| MolName | 2,4-diphenyl-5-[(E)-2-phenylethenyl]-3,4-dihydropyrazole |
| MolecularFormula | C23H20N2 |
| Smiles | C(C1c2ccccc2)N(c2ccccc2)N=C1/C=C/c1ccccc1 |
| InChI | InChI=1S/C23H20N2/c1-4-10-19(11-5-1)16-17-23-22(20-12-6-2-7-13-20)18-25(24-23)21-14-8-3-9-15-21/h1-17,22H,18H2/t22-/m0/s1 |
| InChIK | OAIVOVNJCXXHCI-QFIPXVFZSA-N |
| TotalMolweight | 324.426 |
| Molweight | 324.426 |
| MonoisotopicMass | 324.162648 |
| CLogP | 5.9002 |
| CLogS | -4.834 |
| H Acceptors | 2 |
| TotalSurfaceArea | 265.31 |
| Relative PSA | 0.056764 |
| PolarSurfaceArea | 15.6 |
| Druglikeness | 3.8149 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.52 |
| Fragments | 1 |
| Non HAtoms | 25 |
| NonCHAtoms | 2 |
| Electronegative Atoms | 2 |
| StereoCenters | 1 |
| Rotatable Bond | 4 |
| Rings Closures | 4 |
| Small Rings | 4 |
| Aromatic Rings | 3 |
| Aromatic Atoms | 18 |
| Sp3Atoms | 2 |
| Symmetricatoms | 6 |
| StereoCon | racemate |
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1 - 2,4-diphenyl-5-[(E)-2-phenylethenyl]-3,4-dihydropyrazole | 2 - 2,4-diphenyl-5-[(E)-2-phenylethenyl]-3,4-dihydropyrazole
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