(Z)-3-(3-chlorophenyl)-1-(4-hydroxyphenyl)-2-phenylprop-2-en-1-one
Formula:C21H15O2Cl
Mutagenic:none
Tumorigenic:none
Reproductive Effective:high
(Z)-3-(3-chlorophenyl)-1-(4-hydroxyphenyl)-2-phenylprop-2-en-1-one is a drug-like molecule.
| MolName | (Z)-3-(3-chlorophenyl)-1-(4-hydroxyphenyl)-2-phenylprop-2-en-1-one |
| MolecularFormula | C21H15O2Cl |
| Smiles | Oc(cc1)ccc1C(/C(/c1ccccc1)=C\c1cccc(Cl)c1)=O |
| InChI | InChI=1S/C21H15ClO2/c22-18-8-4-5-15(13-18)14-20(16-6-2-1-3-7-16)21(24)17-9-11-19(23)12-10-17/h1-14,23H |
| InChIK | DRMUAKFZNBEHNS-UHFFFAOYSA-N |
| TotalMolweight | 334.801 |
| Molweight | 334.801 |
| MonoisotopicMass | 334.076057 |
| CLogP | 4.9009 |
| CLogS | -5.237 |
| H Acceptors | 2 |
| H Donors | 1 |
| TotalSurfaceArea | 257.01 |
| Relative PSA | 0.10171 |
| PolarSurfaceArea | 37.3 |
| Druglikeness | 0.5475 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | high |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.5 |
| Fragments | 1 |
| Non HAtoms | 24 |
| NonCHAtoms | 3 |
| Electronegative Atoms | 3 |
| Rotatable Bond | 4 |
| Rings Closures | 3 |
| Small Rings | 3 |
| Aromatic Rings | 3 |
| Aromatic Atoms | 18 |
| Sp3Atoms | 1 |
| Symmetricatoms | 4 |
| StereoCon |
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