[(Z)-[amino-(2,6-dichlorophenyl)methylidene]amino] 3-(2,6-dichlorophenyl)-1,2-thiazole-4-carboxylate

Formula:C17H9N3O2Cl4S Mutagenic:high Tumorigenic:none Reproductive Effective:low [(Z)-[amino-(2,6-dichlorophenyl)methylidene]amino] 3-(2,6-dichlorophenyl)-1,2-thiazole-4-carboxylate is not a drug-like molecule.

MolName[(Z)-[amino-(2,6-dichlorophenyl)methylidene]amino] 3-(2,6-dichlorophenyl)-1,2-thiazole-4-carboxylate
MolecularFormulaC17H9N3O2Cl4S
SmilesN/C(/c(c(Cl)ccc1)c1Cl)=N\OC(c1csnc1-c(c(Cl)ccc1)c1Cl)=O
InChIInChI=1S/C17H9Cl4N3O2S/c18-9-3-1-4-10(19)13(9)15-8(7-27-24-15)17(25)26-23-16(22)14-11(20)5-2-6-12(14)21/h1-7H,(H2,22,23)
InChIKKMSNNTIXNDGART-UHFFFAOYSA-N
TotalMolweight461.155
Molweight461.155
MonoisotopicMass458.916955
CLogP6.522
CLogS-6.498
H Acceptors5
H Donors1
TotalSurfaceArea308.4
Relative PSA0.26313
PolarSurfaceArea105.81
Druglikeness-1.0315
Mutagenichigh
Tumorigenicnone
Reproductive Effectivelow
Irritantnone
Nasty Functions
Shape Index0.51852
Fragments1
Non HAtoms27
NonCHAtoms10
Electronegative Atoms10
Rotatable Bond5
Rings Closures3
Small Rings3
Aromatic Rings3
Aromatic Atoms17
Sp3Atoms1
Symmetricatoms6
Aromatic Nitrogens1
StereoCon

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