(3E)-3-[(2,6-dichlorophenyl)methoxyimino]-1-[(3,4-dichlorophenyl)methyl]indol-2-one
Formula:C22H14N2O2Cl4
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
(3E)-3-[(2,6-dichlorophenyl)methoxyimino]-1-[(3,4-dichlorophenyl)methyl]indol-2-one is not a drug-like molecule.
| MolName | (3E)-3-[(2,6-dichlorophenyl)methoxyimino]-1-[(3,4-dichlorophenyl)methyl]indol-2-one |
| MolecularFormula | C22H14N2O2Cl4 |
| Smiles | O=C1N(Cc(cc2)cc(Cl)c2Cl)c(cccc2)c2/C1=N\OCc(c(Cl)ccc1)c1Cl |
| InChI | InChI=1S/C22H14Cl4N2O2/c23-16-5-3-6-17(24)15(16)12-30-27-21-14-4-1-2-7-20(14)28(22(21)29)11-13-8-9-18(25)19(26)10-13/h1-10H,11-12H2 |
| InChIK | AFMLUWMNZDMOOU-UHFFFAOYSA-N |
| TotalMolweight | 480.177 |
| Molweight | 480.177 |
| MonoisotopicMass | 477.980936 |
| CLogP | 6.6613 |
| CLogS | -8.133 |
| H Acceptors | 4 |
| TotalSurfaceArea | 329.5 |
| Relative PSA | 0.11563 |
| PolarSurfaceArea | 41.9 |
| Druglikeness | 5.4234 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.53333 |
| Fragments | 1 |
| Non HAtoms | 30 |
| NonCHAtoms | 8 |
| Electronegative Atoms | 8 |
| Rotatable Bond | 5 |
| Rings Closures | 4 |
| Small Rings | 4 |
| Aromatic Rings | 3 |
| Aromatic Atoms | 18 |
| Sp3Atoms | 3 |
| Symmetricatoms | 3 |
| Amides | 1 |
| StereoCon |
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1 - (3E)-3-[(2,6-dichlorophenyl)methoxyimino]-1-[(3,4-dichlorophenyl)methyl]indol-2-one | 2 - (3E)-3-[(2,6-dichlorophenyl)methoxyimino]-1-[(3,4-dichlorophenyl)methyl]indol-2-one
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