(2Z)-4-(4-chlorophenyl)-N-(2,4,5-trichloroanilino)-1,3-thiazole-2-carboximidoyl cyanide

Formula:C17H8N4Cl4S Mutagenic:high Tumorigenic:high Reproductive Effective:high (2Z)-4-(4-chlorophenyl)-N-(2,4,5-trichloroanilino)-1,3-thiazole-2-carboximidoyl cyanide is not a drug-like molecule.

MolName	(2Z)-4-(4-chlorophenyl)-N-(2,4,5-trichloroanilino)-1,3-thiazole-2-carboximidoyl cyanide
MolecularFormula	C17H8N4Cl4S
Smiles	N#C/C(/c1nc(-c(cc2)ccc2Cl)cs1)=N/Nc(c(Cl)c1)cc(Cl)c1Cl
InChI	InChI=1S/C17H8Cl4N4S/c18-10-3-1-9(2-4-10)16-8-26-17(23-16)15(7-22)25-24-14-6-12(20)11(19)5-13(14)21/h1-6,8,24H
InChIK	HAANUXIUWHUHIR-UHFFFAOYSA-N
TotalMolweight	442.157
Molweight	442.157
MonoisotopicMass	439.922374
CLogP	7.0287
CLogS	-7.409
H Acceptors	4
H Donors	1
TotalSurfaceArea	305.3
Relative PSA	0.22227
PolarSurfaceArea	89.31
Druglikeness	-0.35901
Mutagenic	high
Tumorigenic	high
Reproductive Effective	high
Irritant	high
Nasty Functions	polyhalo aromatic ring
Shape Index	0.61538
Fragments	1
Non HAtoms	26
NonCHAtoms	9
Electronegative Atoms	9
Rotatable Bond	4
Rings Closures	3
Small Rings	3
Aromatic Rings	3
Aromatic Atoms	17
Symmetricatoms	2
Aromatic Nitrogens	1
StereoCon

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