(Z)-1-(3,4-dichlorophenyl)-N-[4-[(Z)-(3,4-dichlorophenyl)methylideneamino]piperazin-1-yl]methanimine
Formula:C18H16N4Cl4
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
(Z)-1-(3,4-dichlorophenyl)-N-[4-[(Z)-(3,4-dichlorophenyl)methylideneamino]piperazin-1-yl]methanimine is not a drug-like molecule.
| MolName | (Z)-1-(3,4-dichlorophenyl)-N-[4-[(Z)-(3,4-dichlorophenyl)methylideneamino]piperazin-1-yl]methanimine |
| MolecularFormula | C18H16N4Cl4 |
| Smiles | Clc(ccc(/C=N\N(CC1)CCN1/N=C\c(cc1)cc(Cl)c1Cl)c1)c1Cl |
| InChI | InChI=1S/C18H16Cl4N4/c19-15-3-1-13(9-17(15)21)11-23-25-5-7-26(8-6-25)24-12-14-2-4-16(20)18(22)10-14/h1-4,9-12H,5-8H2 |
| InChIK | WALVIZGMSHJSLH-UHFFFAOYSA-N |
| TotalMolweight | 430.165 |
| Molweight | 430.165 |
| MonoisotopicMass | 428.012904 |
| CLogP | 5.683 |
| CLogS | -6.234 |
| H Acceptors | 4 |
| TotalSurfaceArea | 306.36 |
| Relative PSA | 0.098316 |
| PolarSurfaceArea | 31.2 |
| Druglikeness | 5.4627 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | imine/hydrazone of aldehyde |
| Shape Index | 0.69231 |
| Fragments | 1 |
| Non HAtoms | 26 |
| NonCHAtoms | 8 |
| Electronegative Atoms | 8 |
| Rotatable Bond | 4 |
| Rings Closures | 3 |
| Small Rings | 3 |
| Aromatic Rings | 2 |
| Aromatic Atoms | 12 |
| Sp3Atoms | 6 |
| Symmetricatoms | 14 |
| StereoCon |
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1 - (Z)-1-(3,4-dichlorophenyl)-N-[4-[(Z)-(3,4-dichlorophenyl)methylideneamino]piperazin-1-yl]methanimine | 2 - (Z)-1-(3,4-dichlorophenyl)-N-[4-[(Z)-(3,4-dichlorophenyl)methylideneamino]piperazin-1-yl]methanimine
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