1-[(Z)-(4-chloro-3-nitrophenyl)methylideneamino]-3-(2-chlorophenyl)thiourea

Formula:C14H10N4O2Cl2S Mutagenic:high Tumorigenic:none Reproductive Effective:high 1-[(Z)-(4-chloro-3-nitrophenyl)methylideneamino]-3-(2-chlorophenyl)thiourea is a drug-like molecule.

MolName	1-[(Z)-(4-chloro-3-nitrophenyl)methylideneamino]-3-(2-chlorophenyl)thiourea
MolecularFormula	C14H10N4O2Cl2S
Smiles	[O-][N+](c(cc(/C=N\NC(Nc(cccc1)c1Cl)=S)cc1)c1Cl)=O
InChI	InChI=1S/C14H10Cl2N4O2S/c15-10-3-1-2-4-12(10)18-14(23)19-17-8-9-5-6-11(16)13(7-9)20(21)22/h1-8H,(H2,18,19,23)
InChIK	KVGFHVXQOJFYEL-UHFFFAOYSA-N
TotalMolweight	369.231
Molweight	369.231
MonoisotopicMass	367.99015
CLogP	3.8826
CLogS	-6.253
H Acceptors	6
H Donors	2
TotalSurfaceArea	267.92
Relative PSA	0.34656
PolarSurfaceArea	114.33
Druglikeness	-2.9753
Mutagenic	high
Tumorigenic	none
Reproductive Effective	high
Irritant	none
Nasty Functions	aromatic nitro; imine/hydrazone of aldehyde; thio-amide/urea
Shape Index	0.6087
Fragments	1
Non HAtoms	23
NonCHAtoms	9
Electronegative Atoms	9
Rotatable Bond	4
Rings Closures	2
Small Rings	2
Aromatic Rings	2
Aromatic Atoms	12
Sp3Atoms	2
AcidicOxygens	1
StereoCon

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