(5Z)-3-cyclohexyl-2-cyclohexylimino-5-[[5-(3-fluorophenyl)furan-2-yl]methylidene]-1,3-thiazolidin-4-one

Formula:C26H29N2O2FS Mutagenic:high Tumorigenic:high Reproductive Effective:none (5Z)-3-cyclohexyl-2-cyclohexylimino-5-[[5-(3-fluorophenyl)furan-2-yl]methylidene]-1,3-thiazolidin-4-one is not a drug-like molecule.

MolName	(5Z)-3-cyclohexyl-2-cyclohexylimino-5-[[5-(3-fluorophenyl)furan-2-yl]methylidene]-1,3-thiazolidin-4-one
MolecularFormula	C26H29N2O2FS
Smiles	O=C(/C(/S1)=C/c2ccc(-c3cc(F)ccc3)o2)N(C2CCCCC2)/C1=N/C1CCCCC1
InChI	InChI=1S/C26H29FN2O2S/c27-19-9-7-8-18(16-19)23-15-14-22(31-23)17-24-25(30)29(21-12-5-2-6-13-21)26(32-24)28-20-10-3-1-4-11-20/h7-9,14-17,20-21H,1-6,10-13H2
InChIK	JQNFDPDHHHOGKQ-UHFFFAOYSA-N
TotalMolweight	452.592
Molweight	452.592
MonoisotopicMass	452.193376
CLogP	6.0198
CLogS	-7.765
H Acceptors	4
TotalSurfaceArea	344.38
Relative PSA	0.17335
PolarSurfaceArea	71.11
Druglikeness	-3.3291
Mutagenic	high
Tumorigenic	high
Reproductive Effective	none
Irritant	none
Nasty Functions
Shape Index	0.5
Fragments	1
Non HAtoms	32
NonCHAtoms	6
Electronegative Atoms	6
Rotatable Bond	4
Rings Closures	5
Small Rings	5
Aromatic Rings	2
Aromatic Atoms	11
Sp3Atoms	13
Symmetricatoms	4
Amides	1
StereoCon

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