[(Z)-(5,6,7,8-tetrachloro-9,10-dioxoanthracen-2-yl)methylideneamino]urea

Formula:C16H7N3O3Cl4 Mutagenic:high Tumorigenic:high Reproductive Effective:high [(Z)-(5,6,7,8-tetrachloro-9,10-dioxoanthracen-2-yl)methylideneamino]urea is a drug-like molecule.

MolName	[(Z)-(5,6,7,8-tetrachloro-9,10-dioxoanthracen-2-yl)methylideneamino]urea
MolecularFormula	C16H7N3O3Cl4
Smiles	NC(N/N=C\c(cc1)cc(C(c(c2c(c(Cl)c3Cl)Cl)c3Cl)=O)c1C2=O)=O
InChI	InChI=1S/C16H7Cl4N3O3/c17-10-8-9(11(18)13(20)12(10)19)15(25)7-3-5(4-22-23-16(21)26)1-2-6(7)14(8)24/h1-4H,(H3,21,23,26)
InChIK	CYBSBTNKSRIPRV-UHFFFAOYSA-N
TotalMolweight	431.062
Molweight	431.062
MonoisotopicMass	428.92415
CLogP	4.9331
CLogS	-8.872
H Acceptors	6
H Donors	2
TotalSurfaceArea	279.19
Relative PSA	0.27709
PolarSurfaceArea	101.62
Druglikeness	4.6064
Mutagenic	high
Tumorigenic	high
Reproductive Effective	high
Irritant	high
Nasty Functions	imine/hydrazone of aldehyde; polyhalo aromatic ring
Shape Index	0.53846
Fragments	1
Non HAtoms	26
NonCHAtoms	10
Electronegative Atoms	10
Rotatable Bond	2
Rings Closures	3
Small Rings	3
Aromatic Rings	2
Aromatic Atoms	12
Amides	1
StereoCon

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