1-(4-fluorophenyl)-3-[(Z)-(2-phenyl-2,3-dihydrochromen-4-ylidene)amino]thiourea

Formula:C22H18N3OFS Mutagenic:high Tumorigenic:none Reproductive Effective:high 1-(4-fluorophenyl)-3-[(Z)-(2-phenyl-2,3-dihydrochromen-4-ylidene)amino]thiourea is not a drug-like molecule.

MolName	1-(4-fluorophenyl)-3-[(Z)-(2-phenyl-2,3-dihydrochromen-4-ylidene)amino]thiourea
MolecularFormula	C22H18N3OFS
Smiles	Fc(cc1)ccc1NC(N/N=C(/C1)\c(cccc2)c2OC1c1ccccc1)=S
InChI	InChI=1S/C22H18FN3OS/c23-16-10-12-17(13-11-16)24-22(28)26-25-19-14-21(15-6-2-1-3-7-15)27-20-9-5-4-8-18(19)20/h1-13,21H,14H2,(H2,24,26,28)/t21-/m1/s1
InChIK	LDAJEDHWZPEVGW-OAQYLSRUSA-N
TotalMolweight	391.469
Molweight	391.469
MonoisotopicMass	391.11546
CLogP	5.2929
CLogS	-6.223
H Acceptors	4
H Donors	2
TotalSurfaceArea	300.49
Relative PSA	0.24104
PolarSurfaceArea	77.74
Druglikeness	0.3785
Mutagenic	high
Tumorigenic	none
Reproductive Effective	high
Irritant	none
Nasty Functions	thio-amide/urea
Shape Index	0.57143
Fragments	1
Non HAtoms	28
NonCHAtoms	6
Electronegative Atoms	6
StereoCenters	1
Rotatable Bond	3
Rings Closures	4
Small Rings	4
Aromatic Rings	3
Aromatic Atoms	18
Sp3Atoms	4
Symmetricatoms	4
StereoCon	racemate

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