[amino-[(1,1-dioxo-2,3-dihydrothiophen-3-yl)sulfanyl]methylidene]-(2,4,6-trichlorophenyl)azanium

Formula:C11H10N2O2Cl3S2 Mutagenic:high Tumorigenic:none Reproductive Effective:low [amino-[(1,1-dioxo-2,3-dihydrothiophen-3-yl)sulfanyl]methylidene]-(2,4,6-trichlorophenyl)azanium is a drug-like molecule.

MolName	[amino-[(1,1-dioxo-2,3-dihydrothiophen-3-yl)sulfanyl]methylidene]-(2,4,6-trichlorophenyl)azanium
MolecularFormula	C11H10N2O2Cl3S2
Smiles	N/C(/SC(C1)C=CS1(=O)=O)=[NH+]/c(c(Cl)cc(Cl)c1)c1Cl
InChI	InChI=1S/C11H9Cl3N2O2S2/c12-6-3-8(13)10(9(14)4-6)16-11(15)19-7-1-2-20(17,18)5-7/h1-4,7H,5H2,(H2,15,16)/p+1/t7-/m1/s1
InChIK	ZSXQYUWRZUXZNT-SSDOTTSWSA-O
TotalMolweight	372.703
Molweight	372.703
MonoisotopicMass	370.924924
CLogP	2.8675
CLogS	-5.009
H Acceptors	4
H Donors	2
TotalSurfaceArea	224.83
Relative PSA	0.27283
PolarSurfaceArea	107.81
Druglikeness	-3.655
Mutagenic	high
Tumorigenic	none
Reproductive Effective	low
Irritant	low
Nasty Functions	polyhalo aromatic ring
Shape Index	0.6
Fragments	1
Non HAtoms	20
NonCHAtoms	9
Electronegative Atoms	9
StereoCenters	1
Rotatable Bond	3
Rings Closures	2
Small Rings	2
Aromatic Rings	1
Aromatic Atoms	6
Sp3Atoms	4
Symmetricatoms	4
StereoCon	racemate

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1 - [amino-[(1,1-dioxo-2,3-dihydrothiophen-3-yl)sulfanyl]methylidene]-(2,4,6-trichlorophenyl)azanium | 2 - [amino-[(1,1-dioxo-2,3-dihydrothiophen-3-yl)sulfanyl]methylidene]-(2,4,6-trichlorophenyl)azanium

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