(5Z)-3-benzyl-2-benzylimino-5-[[5-(4-iodophenyl)furan-2-yl]methylidene]-1,3-thiazolidin-4-one

Formula:C28H21N2O2IS Mutagenic:high Tumorigenic:high Reproductive Effective:none (5Z)-3-benzyl-2-benzylimino-5-[[5-(4-iodophenyl)furan-2-yl]methylidene]-1,3-thiazolidin-4-one is not a drug-like molecule.

MolName	(5Z)-3-benzyl-2-benzylimino-5-[[5-(4-iodophenyl)furan-2-yl]methylidene]-1,3-thiazolidin-4-one
MolecularFormula	C28H21N2O2IS
Smiles	O=C(/C(/S1)=C/c2ccc(-c(cc3)ccc3I)o2)N(Cc2ccccc2)/C1=N/Cc1ccccc1
InChI	InChI=1S/C28H21IN2O2S/c29-23-13-11-22(12-14-23)25-16-15-24(33-25)17-26-27(32)31(19-21-9-5-2-6-10-21)28(34-26)30-18-20-7-3-1-4-8-20/h1-17H,18-19H2
InChIK	RZDFHAGOCXCYBP-UHFFFAOYSA-N
TotalMolweight	576.453
Molweight	576.453
MonoisotopicMass	576.036846
CLogP	6.0809
CLogS	-7.965
H Acceptors	4
TotalSurfaceArea	375.75
Relative PSA	0.15888
PolarSurfaceArea	71.11
Druglikeness	6.0086
Mutagenic	high
Tumorigenic	high
Reproductive Effective	none
Irritant	none
Nasty Functions
Shape Index	0.52941
Fragments	1
Non HAtoms	34
NonCHAtoms	6
Electronegative Atoms	6
Rotatable Bond	6
Rings Closures	5
Small Rings	5
Aromatic Rings	4
Aromatic Atoms	23
Sp3Atoms	3
Symmetricatoms	6
Amides	1
StereoCon

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