N-[(Z)-(2,3-dichlorophenyl)methylideneamino]-2,3,5,6-tetrafluoroaniline

Formula:C13H6N2Cl2F4 Mutagenic:none Tumorigenic:none Reproductive Effective:none N-[(Z)-(2,3-dichlorophenyl)methylideneamino]-2,3,5,6-tetrafluoroaniline is not a drug-like molecule.

MolNameN-[(Z)-(2,3-dichlorophenyl)methylideneamino]-2,3,5,6-tetrafluoroaniline
MolecularFormulaC13H6N2Cl2F4
SmilesFc(cc(c(F)c1N/N=C\c2cccc(Cl)c2Cl)F)c1F
InChIInChI=1S/C13H6Cl2F4N2/c14-7-3-1-2-6(10(7)15)5-20-21-13-11(18)8(16)4-9(17)12(13)19/h1-5,21H
InChIKPTTULEDWOBOREO-UHFFFAOYSA-N
TotalMolweight337.103
Molweight337.103
MonoisotopicMass335.984414
CLogP6.4561
CLogS-5.877
H Acceptors2
H Donors1
TotalSurfaceArea225.48
Relative PSA0.10187
PolarSurfaceArea24.39
Druglikeness1.0445
Mutagenicnone
Tumorigenicnone
Reproductive Effectivenone
Irritantnone
Nasty Functionsimine/hydrazone of aldehyde; polyhalo aromatic ring
Shape Index0.52381
Fragments1
Non HAtoms21
NonCHAtoms8
Electronegative Atoms8
Rotatable Bond3
Rings Closures2
Small Rings2
Aromatic Rings2
Aromatic Atoms12
Sp3Atoms1
Symmetricatoms4
StereoCon

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