1-(2,5-dichlorophenyl)-3-[[2-[(Z)-(2,4-dichlorophenyl)methylideneamino]oxyacetyl]amino]thiourea

Formula:C16H12N4O2Cl4S Mutagenic:none Tumorigenic:high Reproductive Effective:high 1-(2,5-dichlorophenyl)-3-[[2-[(Z)-(2,4-dichlorophenyl)methylideneamino]oxyacetyl]amino]thiourea is a drug-like molecule.

MolName	1-(2,5-dichlorophenyl)-3-[[2-[(Z)-(2,4-dichlorophenyl)methylideneamino]oxyacetyl]amino]thiourea
MolecularFormula	C16H12N4O2Cl4S
Smiles	O=C(CO/N=C\c(ccc(Cl)c1)c1Cl)NNC(Nc(cc(cc1)Cl)c1Cl)=S
InChI	InChI=1S/C16H12Cl4N4O2S/c17-10-2-1-9(13(20)5-10)7-21-26-8-15(25)23-24-16(27)22-14-6-11(18)3-4-12(14)19/h1-7H,8H2,(H,23,25)(H2,22,24,27)
InChIK	LYZIGWMBPRMZJV-UHFFFAOYSA-N
TotalMolweight	466.175
Molweight	466.175
MonoisotopicMass	463.943504
CLogP	4.8351
CLogS	-7.319
H Acceptors	6
H Donors	3
TotalSurfaceArea	328.06
Relative PSA	0.29546
PolarSurfaceArea	106.84
Druglikeness	3.1598
Mutagenic	none
Tumorigenic	high
Reproductive Effective	high
Irritant	none
Nasty Functions	thio-amide/urea
Shape Index	0.66667
Fragments	1
Non HAtoms	27
NonCHAtoms	11
Electronegative Atoms	11
Rotatable Bond	6
Rings Closures	2
Small Rings	2
Aromatic Rings	2
Aromatic Atoms	12
Sp3Atoms	3
StereoCon

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1 - 1-(2,5-dichlorophenyl)-3-[[2-[(Z)-(2,4-dichlorophenyl)methylideneamino]oxyacetyl]amino]thiourea | 2 - 1-(2,5-dichlorophenyl)-3-[[2-[(Z)-(2,4-dichlorophenyl)methylideneamino]oxyacetyl]amino]thiourea

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