(E)-3-(2,6-dichlorophenyl)-N-(4,5-dihydro-1,3-thiazol-2-yl)prop-2-enamide

Formula:C12H10N2OCl2S Mutagenic:none Tumorigenic:none Reproductive Effective:none (E)-3-(2,6-dichlorophenyl)-N-(4,5-dihydro-1,3-thiazol-2-yl)prop-2-enamide is a drug-like molecule.

MolName	(E)-3-(2,6-dichlorophenyl)-N-(4,5-dihydro-1,3-thiazol-2-yl)prop-2-enamide
MolecularFormula	C12H10N2OCl2S
Smiles	O=C(/C=C/c(c(Cl)ccc1)c1Cl)NC1=NCCS1
InChI	InChI=1S/C12H10Cl2N2OS/c13-9-2-1-3-10(14)8(9)4-5-11(17)16-12-15-6-7-18-12/h1-5H,6-7H2,(H,15,16,17)
InChIK	SUXDMYZOUIZBAG-UHFFFAOYSA-N
TotalMolweight	301.196
Molweight	301.196
MonoisotopicMass	299.989087
CLogP	2.844
CLogS	-4.687
H Acceptors	3
H Donors	1
TotalSurfaceArea	214.29
Relative PSA	0.24966
PolarSurfaceArea	66.76
Druglikeness	0.92032
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions
Shape Index	0.61111
Fragments	1
Non HAtoms	18
NonCHAtoms	6
Electronegative Atoms	6
Rotatable Bond	2
Rings Closures	2
Small Rings	2
Aromatic Rings	1
Aromatic Atoms	6
Sp3Atoms	3
Symmetricatoms	3
Amides	1
StereoCon

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