[(E)-[cyano-(2,6-dichlorophenyl)methylidene]amino] 3,4-dichlorobenzenesulfonate

Formula:C14H6N2O3Cl4S Mutagenic:none Tumorigenic:none Reproductive Effective:none [(E)-[cyano-(2,6-dichlorophenyl)methylidene]amino] 3,4-dichlorobenzenesulfonate is not a drug-like molecule.

MolName	[(E)-[cyano-(2,6-dichlorophenyl)methylidene]amino] 3,4-dichlorobenzenesulfonate
MolecularFormula	C14H6N2O3Cl4S
Smiles	N#C/C(/c(c(Cl)ccc1)c1Cl)=N/OS(c(cc1)cc(Cl)c1Cl)(=O)=O
InChI	InChI=1S/C14H6Cl4N2O3S/c15-9-5-4-8(6-12(9)18)24(21,22)23-20-13(7-19)14-10(16)2-1-3-11(14)17/h1-6H
InChIK	SYCDKHGHABLBNY-UHFFFAOYSA-N
TotalMolweight	424.091
Molweight	424.091
MonoisotopicMass	421.885321
CLogP	5.7501
CLogS	-6.296
H Acceptors	5
TotalSurfaceArea	277.96
Relative PSA	0.22899
PolarSurfaceArea	87.9
Druglikeness	-3.5035
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions
Shape Index	0.54167
Fragments	1
Non HAtoms	24
NonCHAtoms	10
Electronegative Atoms	10
Rotatable Bond	4
Rings Closures	2
Small Rings	2
Aromatic Rings	2
Aromatic Atoms	12
Sp3Atoms	2
Symmetricatoms	4
StereoCon

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