1-[(Z)-[2-[(2-fluorophenyl)methoxy]naphthalen-1-yl]methylideneamino]-3-phenylthiourea

Formula:C25H20N3OFS Mutagenic:high Tumorigenic:high Reproductive Effective:high 1-[(Z)-[2-[(2-fluorophenyl)methoxy]naphthalen-1-yl]methylideneamino]-3-phenylthiourea is not a drug-like molecule.

MolName	1-[(Z)-[2-[(2-fluorophenyl)methoxy]naphthalen-1-yl]methylideneamino]-3-phenylthiourea
MolecularFormula	C25H20N3OFS
Smiles	Fc1c(COc2c(/C=N\NC(Nc3ccccc3)=S)c3ccccc3cc2)cccc1
InChI	InChI=1S/C25H20FN3OS/c26-23-13-7-5-9-19(23)17-30-24-15-14-18-8-4-6-12-21(18)22(24)16-27-29-25(31)28-20-10-2-1-3-11-20/h1-16H,17H2,(H2,28,29,31)
InChIK	SCTWQVPNWBPYEK-UHFFFAOYSA-N
TotalMolweight	429.518
Molweight	429.518
MonoisotopicMass	429.13111
CLogP	6.2355
CLogS	-7.582
H Acceptors	4
H Donors	2
TotalSurfaceArea	337.88
Relative PSA	0.21437
PolarSurfaceArea	77.74
Druglikeness	0.46209
Mutagenic	high
Tumorigenic	high
Reproductive Effective	high
Irritant	none
Nasty Functions	imine/hydrazone of aldehyde; thio-amide/urea
Shape Index	0.54839
Fragments	1
Non HAtoms	31
NonCHAtoms	6
Electronegative Atoms	6
Rotatable Bond	6
Rings Closures	4
Small Rings	4
Aromatic Rings	4
Aromatic Atoms	22
Sp3Atoms	3
Symmetricatoms	2
StereoCon

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