(E)-N-[4-(4-iodophenyl)-1,3-thiazol-2-yl]-3-thiophen-2-ylprop-2-enamide

Formula:C16H11N2OIS2 Mutagenic:none Tumorigenic:none Reproductive Effective:none (E)-N-[4-(4-iodophenyl)-1,3-thiazol-2-yl]-3-thiophen-2-ylprop-2-enamide is a drug-like molecule.

MolName	(E)-N-[4-(4-iodophenyl)-1,3-thiazol-2-yl]-3-thiophen-2-ylprop-2-enamide
MolecularFormula	C16H11N2OIS2
Smiles	O=C(/C=C/c1cccs1)Nc1nc(-c(cc2)ccc2I)cs1
InChI	InChI=1S/C16H11IN2OS2/c17-12-5-3-11(4-6-12)14-10-22-16(18-14)19-15(20)8-7-13-2-1-9-21-13/h1-10H,(H,18,19,20)
InChIK	WQLLZXBCRMUMOE-UHFFFAOYSA-N
TotalMolweight	438.308
Molweight	438.308
MonoisotopicMass	437.935751
CLogP	4.8155
CLogS	-6.035
H Acceptors	3
H Donors	1
TotalSurfaceArea	265.41
Relative PSA	0.28707
PolarSurfaceArea	98.47
Druglikeness	3.185
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions	limit! thiazol-2-ylamine
Shape Index	0.68182
Fragments	1
Non HAtoms	22
NonCHAtoms	6
Electronegative Atoms	6
Rotatable Bond	4
Rings Closures	3
Small Rings	3
Aromatic Rings	3
Aromatic Atoms	16
Symmetricatoms	2
Amides	1
Aromatic Nitrogens	1
StereoCon

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