1-[(Z)-(3,4-difluorophenyl)methylideneamino]-3-(4-fluorophenyl)thiourea

Formula:C14H10N3F3S Mutagenic:high Tumorigenic:none Reproductive Effective:high 1-[(Z)-(3,4-difluorophenyl)methylideneamino]-3-(4-fluorophenyl)thiourea is a drug-like molecule.

MolName	1-[(Z)-(3,4-difluorophenyl)methylideneamino]-3-(4-fluorophenyl)thiourea
MolecularFormula	C14H10N3F3S
Smiles	Fc(cc1)ccc1NC(N/N=C\c(cc1)cc(F)c1F)=S
InChI	InChI=1S/C14H10F3N3S/c15-10-2-4-11(5-3-10)19-14(21)20-18-8-9-1-6-12(16)13(17)7-9/h1-8H,(H2,19,20,21)
InChIK	FNCJFPLQBSHHID-UHFFFAOYSA-N
TotalMolweight	309.314
Molweight	309.314
MonoisotopicMass	309.054751
CLogP	3.8946
CLogS	-5.263
H Acceptors	3
H Donors	2
TotalSurfaceArea	232.46
Relative PSA	0.26856
PolarSurfaceArea	68.51
Druglikeness	0.8925
Mutagenic	high
Tumorigenic	none
Reproductive Effective	high
Irritant	none
Nasty Functions	imine/hydrazone of aldehyde; thio-amide/urea
Shape Index	0.71429
Fragments	1
Non HAtoms	21
NonCHAtoms	7
Electronegative Atoms	7
Rotatable Bond	3
Rings Closures	2
Small Rings	2
Aromatic Rings	2
Aromatic Atoms	12
Sp3Atoms	1
Symmetricatoms	2
StereoCon

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