1-(2-fluorophenyl)-3-[(Z)-(5-morpholin-4-ylfuran-2-yl)methylideneamino]thiourea

Formula:C16H17N4O2FS Mutagenic:high Tumorigenic:high Reproductive Effective:high 1-(2-fluorophenyl)-3-[(Z)-(5-morpholin-4-ylfuran-2-yl)methylideneamino]thiourea is a drug-like molecule.

MolName	1-(2-fluorophenyl)-3-[(Z)-(5-morpholin-4-ylfuran-2-yl)methylideneamino]thiourea
MolecularFormula	C16H17N4O2FS
Smiles	Fc(cccc1)c1NC(N/N=C\c1ccc(N2CCOCC2)o1)=S
InChI	InChI=1S/C16H17FN4O2S/c17-13-3-1-2-4-14(13)19-16(24)20-18-11-12-5-6-15(23-12)21-7-9-22-10-8-21/h1-6,11H,7-10H2,(H2,19,20,24)
InChIK	NTEQQDFQKRHAEQ-UHFFFAOYSA-N
TotalMolweight	348.401
Molweight	348.401
MonoisotopicMass	348.105624
CLogP	2.9021
CLogS	-4.945
H Acceptors	6
H Donors	2
TotalSurfaceArea	271.29
Relative PSA	0.33208
PolarSurfaceArea	94.12
Druglikeness	4.0719
Mutagenic	high
Tumorigenic	high
Reproductive Effective	high
Irritant	none
Nasty Functions	imine/hydrazone of aldehyde; thio-amide/urea
Shape Index	0.66667
Fragments	1
Non HAtoms	24
NonCHAtoms	8
Electronegative Atoms	8
Rotatable Bond	4
Rings Closures	3
Small Rings	3
Aromatic Rings	2
Aromatic Atoms	11
Sp3Atoms	6
Symmetricatoms	2
StereoCon

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