(E)-1-(4-chlorophenyl)-3-[2-(4-chlorophenyl)-1H-indol-3-yl]prop-2-en-1-one
Formula:C23H15NOCl2
Mutagenic:none
Tumorigenic:none
Reproductive Effective:high
(E)-1-(4-chlorophenyl)-3-[2-(4-chlorophenyl)-1H-indol-3-yl]prop-2-en-1-one is not a drug-like molecule.
| MolName | (E)-1-(4-chlorophenyl)-3-[2-(4-chlorophenyl)-1H-indol-3-yl]prop-2-en-1-one |
| MolecularFormula | C23H15NOCl2 |
| Smiles | O=C(/C=C/c1c(-c(cc2)ccc2Cl)[nH]c2c1cccc2)c(cc1)ccc1Cl |
| InChI | InChI=1S/C23H15Cl2NO/c24-17-9-5-15(6-10-17)22(27)14-13-20-19-3-1-2-4-21(19)26-23(20)16-7-11-18(25)12-8-16/h1-14,26H |
| InChIK | FJAQAXXWNWGELR-UHFFFAOYSA-N |
| TotalMolweight | 392.284 |
| Molweight | 392.284 |
| MonoisotopicMass | 391.053068 |
| CLogP | 6.3054 |
| CLogS | -7.615 |
| H Acceptors | 2 |
| H Donors | 1 |
| TotalSurfaceArea | 292.04 |
| Relative PSA | 0.092556 |
| PolarSurfaceArea | 32.86 |
| Druglikeness | 1.5697 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | high |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.55556 |
| Fragments | 1 |
| Non HAtoms | 27 |
| NonCHAtoms | 4 |
| Electronegative Atoms | 4 |
| Rotatable Bond | 4 |
| Rings Closures | 4 |
| Small Rings | 4 |
| Aromatic Rings | 4 |
| Aromatic Atoms | 21 |
| Symmetricatoms | 4 |
| Aromatic Nitrogens | 1 |
| StereoCon |
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