(3Z)-3-[[3-chloro-4-[(3,4-dichlorophenyl)methoxy]phenyl]methylidene]-1H-indol-2-one
Formula:C22H14NO2Cl3
Mutagenic:none
Tumorigenic:none
Reproductive Effective:high
(3Z)-3-[[3-chloro-4-[(3,4-dichlorophenyl)methoxy]phenyl]methylidene]-1H-indol-2-one is not a drug-like molecule.
| MolName | (3Z)-3-[[3-chloro-4-[(3,4-dichlorophenyl)methoxy]phenyl]methylidene]-1H-indol-2-one |
| MolecularFormula | C22H14NO2Cl3 |
| Smiles | O=C1Nc(cccc2)c2/C1=C/c(cc1)cc(Cl)c1OCc(cc1)cc(Cl)c1Cl |
| InChI | InChI=1S/C22H14Cl3NO2/c23-17-7-5-14(11-18(17)24)12-28-21-8-6-13(10-19(21)25)9-16-15-3-1-2-4-20(15)26-22(16)27/h1-11H,12H2,(H,26,27) |
| InChIK | LWYLQDUXYVGEDA-UHFFFAOYSA-N |
| TotalMolweight | 430.717 |
| Molweight | 430.717 |
| MonoisotopicMass | 429.00901 |
| CLogP | 5.4318 |
| CLogS | -6.918 |
| H Acceptors | 3 |
| H Donors | 1 |
| TotalSurfaceArea | 303.22 |
| Relative PSA | 0.11378 |
| PolarSurfaceArea | 38.33 |
| Druglikeness | 2.488 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | high |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.60714 |
| Fragments | 1 |
| Non HAtoms | 28 |
| NonCHAtoms | 6 |
| Electronegative Atoms | 6 |
| Rotatable Bond | 4 |
| Rings Closures | 4 |
| Small Rings | 4 |
| Aromatic Rings | 3 |
| Aromatic Atoms | 18 |
| Sp3Atoms | 2 |
| Amides | 1 |
| StereoCon |
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1 - (3Z)-3-[[3-chloro-4-[(3,4-dichlorophenyl)methoxy]phenyl]methylidene]-1H-indol-2-one | 2 - (3Z)-3-[[3-chloro-4-[(3,4-dichlorophenyl)methoxy]phenyl]methylidene]-1H-indol-2-one
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