[(E)-[amino-(4-chlorophenyl)methylidene]amino] 2-(2,4-dichlorophenoxy)acetate

Formula:C15H11N2O3Cl3 Mutagenic:high Tumorigenic:high Reproductive Effective:high [(E)-[amino-(4-chlorophenyl)methylidene]amino] 2-(2,4-dichlorophenoxy)acetate is a drug-like molecule.

MolName[(E)-[amino-(4-chlorophenyl)methylidene]amino] 2-(2,4-dichlorophenoxy)acetate
MolecularFormulaC15H11N2O3Cl3
SmilesN/C(/c(cc1)ccc1Cl)=N/OC(COc(ccc(Cl)c1)c1Cl)=O
InChIInChI=1S/C15H11Cl3N2O3/c16-10-3-1-9(2-4-10)15(19)20-23-14(21)8-22-13-6-5-11(17)7-12(13)18/h1-7H,8H2,(H2,19,20)
InChIKJUYICZAWQPDQTD-UHFFFAOYSA-N
TotalMolweight373.622
Molweight373.622
MonoisotopicMass371.983524
CLogP4.465
CLogS-5.524
H Acceptors5
H Donors1
TotalSurfaceArea262.28
Relative PSA0.22808
PolarSurfaceArea73.91
Druglikeness-2.5475
Mutagenichigh
Tumorigenichigh
Reproductive Effectivehigh
Irritanthigh
Nasty Functions
Shape Index0.69565
Fragments1
Non HAtoms23
NonCHAtoms8
Electronegative Atoms8
Rotatable Bond6
Rings Closures2
Small Rings2
Aromatic Rings2
Aromatic Atoms12
Sp3Atoms3
Symmetricatoms2
StereoCon

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