(5E)-5-(furan-2-ylmethylidene)-2-[2-(2-hydroxyethyl)piperidin-1-yl]-1,3-thiazol-4-one

Formula:C15H18N2O3S Mutagenic:high Tumorigenic:none Reproductive Effective:low (5E)-5-(furan-2-ylmethylidene)-2-[2-(2-hydroxyethyl)piperidin-1-yl]-1,3-thiazol-4-one is a drug-like molecule.

MolName	(5E)-5-(furan-2-ylmethylidene)-2-[2-(2-hydroxyethyl)piperidin-1-yl]-1,3-thiazol-4-one
MolecularFormula	C15H18N2O3S
Smiles	OCCC(CCCC1)N1C(S/C1=C/c2ccco2)=NC1=O
InChI	InChI=1S/C15H18N2O3S/c18-8-6-11-4-1-2-7-17(11)15-16-14(19)13(21-15)10-12-5-3-9-20-12/h3,5,9-11,18H,1-2,4,6-8H2/t11-/m1/s1
InChIK	VYPRXQIBTVMKRP-LLVKDONJSA-N
TotalMolweight	306.385
Molweight	306.385
MonoisotopicMass	306.103813
CLogP	1.7901
CLogS	-3.622
H Acceptors	5
H Donors	1
TotalSurfaceArea	230.58
Relative PSA	0.31573
PolarSurfaceArea	91.34
Druglikeness	0.077426
Mutagenic	high
Tumorigenic	none
Reproductive Effective	low
Irritant	none
Nasty Functions
Shape Index	0.57143
Fragments	1
Non HAtoms	21
NonCHAtoms	6
Electronegative Atoms	6
StereoCenters	1
Rotatable Bond	3
Rings Closures	3
Small Rings	3
Aromatic Rings	1
Aromatic Atoms	5
Sp3Atoms	9
BasicNitrogens	1
StereoCon	racemate

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