(E)-N-[(2,5-dichlorophenyl)methoxy]-1,2-diphenyl-6,7-dihydro-5H-indol-4-imine
Formula:C27H22N2OCl2
Mutagenic:none
Tumorigenic:high
Reproductive Effective:high
(E)-N-[(2,5-dichlorophenyl)methoxy]-1,2-diphenyl-6,7-dihydro-5H-indol-4-imine is not a drug-like molecule.
| MolName | (E)-N-[(2,5-dichlorophenyl)methoxy]-1,2-diphenyl-6,7-dihydro-5H-indol-4-imine |
| MolecularFormula | C27H22N2OCl2 |
| Smiles | Clc(cc1)cc(CO/N=C(\CCC2)/c(cc3-c4ccccc4)c2n3-c2ccccc2)c1Cl |
| InChI | InChI=1S/C27H22Cl2N2O/c28-21-14-15-24(29)20(16-21)18-32-30-25-12-7-13-26-23(25)17-27(19-8-3-1-4-9-19)31(26)22-10-5-2-6-11-22/h1-6,8-11,14-17H,7,12-13,18H2 |
| InChIK | WQIGZVLFSWCDEF-UHFFFAOYSA-N |
| TotalMolweight | 461.391 |
| Molweight | 461.391 |
| MonoisotopicMass | 460.110917 |
| CLogP | 7.7095 |
| CLogS | -10.178 |
| H Acceptors | 3 |
| TotalSurfaceArea | 347.09 |
| Relative PSA | 0.081766 |
| PolarSurfaceArea | 26.52 |
| Druglikeness | 0.48637 |
| Mutagenic | none |
| Tumorigenic | high |
| Reproductive Effective | high |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.46875 |
| Fragments | 1 |
| Non HAtoms | 32 |
| NonCHAtoms | 5 |
| Electronegative Atoms | 5 |
| Rotatable Bond | 5 |
| Rings Closures | 5 |
| Small Rings | 5 |
| Aromatic Rings | 4 |
| Aromatic Atoms | 23 |
| Sp3Atoms | 5 |
| Symmetricatoms | 4 |
| Aromatic Nitrogens | 1 |
| StereoCon |
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1 - (E)-N-[(2,5-dichlorophenyl)methoxy]-1,2-diphenyl-6,7-dihydro-5H-indol-4-imine | 2 - (E)-N-[(2,5-dichlorophenyl)methoxy]-1,2-diphenyl-6,7-dihydro-5H-indol-4-imine
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