[(Z)-[4-bromo-5-(4-chlorophenyl)sulfanylfuran-2-yl]methylideneamino]urea

Formula:C12H9N3O2BrClS Mutagenic:high Tumorigenic:none Reproductive Effective:none [(Z)-[4-bromo-5-(4-chlorophenyl)sulfanylfuran-2-yl]methylideneamino]urea is a drug-like molecule.

MolName	[(Z)-[4-bromo-5-(4-chlorophenyl)sulfanylfuran-2-yl]methylideneamino]urea
MolecularFormula	C12H9N3O2BrClS
Smiles	NC(N/N=C\c(o1)cc(Br)c1Sc(cc1)ccc1Cl)=O
InChI	InChI=1S/C12H9BrClN3O2S/c13-10-5-8(6-16-17-12(15)18)19-11(10)20-9-3-1-7(14)2-4-9/h1-6H,(H3,15,17,18)
InChIK	GGSQRTPEHQCSSN-UHFFFAOYSA-N
TotalMolweight	374.645
Molweight	374.645
MonoisotopicMass	372.928735
CLogP	3.5737
CLogS	-5.615
H Acceptors	5
H Donors	2
TotalSurfaceArea	236.74
Relative PSA	0.35009
PolarSurfaceArea	105.92
Druglikeness	-0.68933
Mutagenic	high
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions	imine/hydrazone of aldehyde
Shape Index	0.7
Fragments	1
Non HAtoms	20
NonCHAtoms	8
Electronegative Atoms	8
Rotatable Bond	4
Rings Closures	2
Small Rings	2
Aromatic Rings	2
Aromatic Atoms	11
Sp3Atoms	1
Symmetricatoms	2
Amides	1
StereoCon

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