(Z)-2-imidazol-1-yl-3-phenyl-1-(2-phenylmethoxyphenyl)prop-2-en-1-one
Formula:C25H20N2O2
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
(Z)-2-imidazol-1-yl-3-phenyl-1-(2-phenylmethoxyphenyl)prop-2-en-1-one is a drug-like molecule.
| MolName | (Z)-2-imidazol-1-yl-3-phenyl-1-(2-phenylmethoxyphenyl)prop-2-en-1-one |
| MolecularFormula | C25H20N2O2 |
| Smiles | O=C(/C(/n1cncc1)=C/c1ccccc1)c(cccc1)c1OCc1ccccc1 |
| InChI | InChI=1S/C25H20N2O2/c28-25(23(27-16-15-26-19-27)17-20-9-3-1-4-10-20)22-13-7-8-14-24(22)29-18-21-11-5-2-6-12-21/h1-17,19H,18H2 |
| InChIK | OQMSGKDULKTGDY-UHFFFAOYSA-N |
| TotalMolweight | 380.446 |
| Molweight | 380.446 |
| MonoisotopicMass | 380.152478 |
| CLogP | 4.6072 |
| CLogS | -5.206 |
| H Acceptors | 4 |
| TotalSurfaceArea | 306.72 |
| Relative PSA | 0.13328 |
| PolarSurfaceArea | 44.12 |
| Druglikeness | 2.7363 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.51724 |
| Fragments | 1 |
| Non HAtoms | 29 |
| NonCHAtoms | 4 |
| Electronegative Atoms | 4 |
| Rotatable Bond | 7 |
| Rings Closures | 4 |
| Small Rings | 4 |
| Aromatic Rings | 4 |
| Aromatic Atoms | 23 |
| Sp3Atoms | 2 |
| Symmetricatoms | 4 |
| Aromatic Nitrogens | 2 |
| BasicNitrogens | 1 |
| StereoCon |
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